SCHEMBL332057

SCHEMBL332057

O=C(Nc1cc(Cl)cc(Cl)c1)c1cc(Cl)ccc1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
P2RX1 P51575 11/20 1.00
TMPRSS4 Q9NRS4 11/20 1.00
P2RX4 Q99571 6/20 1.00
P2RX7 Q99572 6/20 1.00
KCNMA1 Q12791 3/20 0.69
MEN1 O00255 1/20 0.68
IKBKB O14920 1/20 0.68
CHUK O15111 1/20 0.68
KDR P35968 1/20 0.68
FLT3 P36888 1/20 0.68
KMT2A Q03164 1/20 0.68
MYLK Q15746 1/20 0.68
MAP4K5 Q9Y4K4 1/20 0.68
SLC2A1 P11166 1/20 0.59

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29454776 0.88 P2RX1 (1.00) P2RX1TMPRSS4P2RX4P2RX7KCNMA1
SCHEMBL2169619 0.88 P2RX1 (1.00) P2RX1TMPRSS4P2RX4P2RX7KCNMA1
SCHEMBL11932152 0.87 P2RX1 (1.00) P2RX1TMPRSS4P2RX4P2RX7KCNMA1
SCHEMBL14886091 0.87 P2RX1 (0.77) P2RX1TMPRSS4P2RX4P2RX7KCNMA1
SCHEMBL330564 0.86 P2RX1 (0.76) P2RX1TMPRSS4P2RX4P2RX7KCNMA1
SCHEMBL330059 0.85 TMPRSS4 (0.90) P2RX1TMPRSS4P2RX4P2RX7MEN1
SCHEMBL330901 0.85 P2RX1 (0.74) P2RX1TMPRSS4P2RX4P2RX7KCNMA1
SCHEMBL331484 0.85 P2RX1 (0.74) P2RX1TMPRSS4P2RX4P2RX7KCNMA1
SCHEMBL330475 0.85 P2RX1 (0.74) P2RX1TMPRSS4P2RX4P2RX7KCNMA1
SCHEMBL330690 0.85 P2RX1 (0.74) P2RX1TMPRSS4P2RX4P2RX7KCNMA1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 81 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200038350-A1 CHEMICAL MODULATORS OF SIGNALING PATHWAYS AND THERAPEUTIC USE DUKE UNIVERSITY 2020-02-06 US claimed
US-20190077772-A1 CHEMICAL MODULATORS OF IMMUNE CHECKPOINTS AND THERAPEUTIC USE DUKE UNIVERSITY 2019-03-14 US claimed
EP-3313388-A1 CHEMICAL MODULATORS OF SIGNALING PATHWAYS AND THERAPEUTIC USE Duke University (US) 2018-05-02 EP claimed
WO-2016210289-A1 CHEMICAL MODULATORS OF SIGNALING PATHWAYS AND THERAPEUTIC USE DUKE UNIVERSITY (US) 2016-12-29 WO claimed
US-20140221411-A1 2-HYDROXYARYLAMIDE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING CANCER CONTAINING SAME AS ACTIVE INGREDIENT KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2014-08-07 US claimed
US-12496308-B2 Methods of administering a pharmaceutically acceptable salt of 2-{[3,5-bis(trifluoromethyl)phenyl]carbamoyl}-4-chlorophenyl dihydrogen phosphate AEROMICS, INC. (US) 2025-12-16 US disclosed
US-12213987-B2 Prodrug salts AEROMICS, INC. (US) 2025-02-04 US disclosed
US-20240299425-A1 FORMULATIONS AEROMICS, INC. 2024-09-12 US disclosed
US-11801254-B2 Pharmaceutical compositions and methods of making pharmaceutical compositions comprising 2-{[3,5-bis(trifluoromethyl)phenyl]carbamoyl}-4-chlorophenyl dihydrogen phosphate AEROMICS, INC. (US) 2023-10-31 US disclosed
US-11793777-B2 Methods and compositions for treating conditions associated with an abnormal inflammatory response FIRST WAVE BIO, INC. (US) 2023-10-24 US disclosed
US-11793777-B2 Methods and compositions for treating conditions associated with an abnormal inflammatory response FIRST WAVE BIO, INC. (US) 2023-10-24 US disclosed
US-20220143048-A1 NOVEL PRODRUG SALTS AEROMICS, INC. 2022-05-12 US disclosed
US-20100113770-A1 O-SUBSTITUTED HYDROXYARYL DERIVATIVES INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2010-05-06 US disclosed
US-7626042-B2 O-substituted hydroxyaryl derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2009-12-01 US disclosed
EP-1847263-A2 Inhibitors against the production and release of inflammatory cytokines Institute of Medicinal Molecular Design, Inc. (JP) 2007-10-24 EP disclosed
EP-1844766-A2 Inhibitors against the production and release of inflammatory cytokines Institute of Medicinal Molecular Design, Inc. (JP) 2007-10-17 EP disclosed
US-20060094718-A1 2-Morpholinocarbonyloxy-),5-(phenylethenyl,N-((3,5-bistrifluoromethyl-)phenyl)-benzamide; inhibitors of nuclear factor kappa B activation; cytokine suppressive antiinflammatory drugs(interleukin (IL-1, IL-6, IL-8) inhibitors); tumor necrosis factor (TNF-alpha) inhibitors; side effects reduction INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2006-05-04 US disclosed
EP-1512397-A1 O-SUBSTITUTED HYDROXYARYL DERIVATIVES Institute of Medicinal Molecular Design, Inc. (JP) 2005-03-09 EP disclosed
US-20040259877-A1 Inhibitors against the production and release of inflammatory cytokines INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2004-12-23 US disclosed
EP-1352650-A1 INHIBITORS AGAINST THE PRODUCTION AND RELEASE OF INFLAMMATORY CYTOKINES Institute of Medicinal Molecular Design, Inc. (JP) 2003-10-15 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (12 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11801254-B2 Pharmaceutical compositions and methods of making pharmaceutical compositions comprising 2-{[3,5-bis(trifluoromethyl)phenyl]carbamoyl}-4-chlorophenyl dihydrogen phosphate PLCG2, DCTPP1, PLCG1 P2RX1 790/4885TMPRSS4 1479/4885P2RX4 274/4885
US-12496308-B2 Methods of administering a pharmaceutically acceptable salt of 2-{[3,5-bis(trifluoromethyl)phenyl]carbamoyl}-4-chlorophenyl dihydrogen phosphate SLC34A2, SLC20A2, SLC34A3 P2RX1 1611/4885TMPRSS4 1440/4885P2RX4 674/4885
US-20060094718-A1 2-Morpholinocarbonyloxy-),5-(phenylethenyl,N-((3,5-bistrifluoromethyl-)phenyl)-benzamide; inhibitors of nuclear factor kappa B activation; cytokine suppressive antiinflammatory drugs(interleukin (IL-1, IL-6, IL-8) inhibitors); tumor necrosis factor (TNF-alpha) inhibitors; side effects reduction IL1A, TNF, NFKBIA P2RX1 2507/4885TMPRSS4 4278/4885P2RX4 3900/4885
US-20240299425-A1 FORMULATIONS DCPS, PPIP5K2, PRCP P2RX1 883/4885TMPRSS4 871/4885P2RX4 346/4885
US-12213987-B2 Prodrug salts AQP4, AQP1, AQP3 P2RX1 556/4885TMPRSS4 1144/4885P2RX4 649/4885
US-20190077772-A1 CHEMICAL MODULATORS OF IMMUNE CHECKPOINTS AND THERAPEUTIC USE CD274, PDCD1, PDCD1LG2 P2RX1 1425/4885TMPRSS4 1233/4885P2RX4 1249/4885
US-20200038350-A1 CHEMICAL MODULATORS OF SIGNALING PATHWAYS AND THERAPEUTIC USE SFRP1, FZD7, WNT1 P2RX1 3423/4885TMPRSS4 2074/4885P2RX4 3784/4885
US-20220143048-A1 NOVEL PRODRUG SALTS AQP4, AQP1, AQP3 P2RX1 543/4885TMPRSS4 1033/4885P2RX4 640/4885
US-20100113770-A1 O-SUBSTITUTED HYDROXYARYL DERIVATIVES RELA, NFKBIA, NFE2 P2RX1 3644/4885TMPRSS4 3984/4885P2RX4 4206/4885
US-20140221411-A1 2-HYDROXYARYLAMIDE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING CANCER CONTAINING SAME AS ACTIVE INGREDIENT TMPRSS2, TMPRSS4, PRSS2 P2RX1 4273/4885TMPRSS4 2/4885P2RX4 3330/4885
US-20040259877-A1 Inhibitors against the production and release of inflammatory cytokines NFKBIA, IL1B, IKBKB P2RX1 2316/4885TMPRSS4 3292/4885P2RX4 3466/4885
US-11793777-B2 Methods and compositions for treating conditions associated with an abnormal inflammatory response FH, CS, ECHS1 P2RX1 910/4885TMPRSS4 2067/4885P2RX4 694/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.