SCHEMBL330387

SCHEMBL330387

O=C(Nc1cc(Cl)ccc1Cl)c1cc(Cl)ccc1O

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNMA1 Q12791 5/20 0.81
P2RX1 P51575 9/20 0.69
TMPRSS4 Q9NRS4 6/20 0.69
P2RX4 Q99571 4/20 0.69
P2RX7 Q99572 4/20 0.69
TAS1R3 Q7RTX0 1/20 0.62
TAS1R1 Q7RTX1 1/20 0.62
TAS1R2 Q8TE23 1/20 0.62
MEN1 O00255 3/20 0.60
KMT2A Q03164 3/20 0.60
KDR P35968 2/20 0.60
AURKA O14965 1/20 0.60
NPC1 O15118 1/20 0.60
PDPK1 O15530 1/20 0.60
JAK2 O60674 1/20 0.60
GMNN O75496 1/20 0.60
ALDH1A1 P00352 1/20 0.60
EGFR P00533 1/20 0.60
LMNA P02545 1/20 0.60
TP53 P04637 1/20 0.60

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
SCHEMBL14363353 0.90 KCNMA1 (0.66) KCNMA1P2RX1TMPRSS4P2RX4P2RX7
SCHEMBL31093979 0.87 KCNMA1 (0.71) KCNMA1P2RX1TMPRSS4P2RX4P2RX7
SCHEMBL16147455 0.87 KCNMA1 (0.71) KCNMA1P2RX1TMPRSS4P2RX4P2RX7
SCHEMBL10589125 0.87 KCNMA1 (0.81) KCNMA1P2RX1TMPRSS4P2RX4P2RX7
SCHEMBL15026045 0.87 KCNMA1 (0.76) KCNMA1P2RX1TMPRSS4P2RX4P2RX7
SCHEMBL30771727 0.87 KCNMA1 (0.76) KCNMA1P2RX1TMPRSS4P2RX4P2RX7
SCHEMBL24460172 0.86 P2RX1 (0.70) KCNMA1P2RX1TMPRSS4P2RX4P2RX7
SCHEMBL30771752 0.86 P2RX1 (0.70) KCNMA1P2RX1TMPRSS4P2RX4P2RX7
SCHEMBL330023 0.86 TMPRSS4 (0.83) KCNMA1P2RX1TMPRSS4P2RX4P2RX7
SCHEMBL8042390 0.85 KMT2A (0.81) KCNMA1P2RX1P2RX4P2RX7MEN1

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 40 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
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-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-20220000812-A1 METHODS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH AN ABNORMAL INFLAMMATORY RESPONSES FIRST WAVE BIO, INC. 2022-01-06 US disclosed
US-20210401784-A1 METHODS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH AN ABNORMAL INFLAMMATORY RESPONSE FIRST WAVE BIO, INC. 2021-12-30 US disclosed
US-10912746-B2 Methods and compositions for treating conditions associated with an abnormal inflammatory response FIRST WAVE BIO, INC. (US) 2021-02-09 US disclosed
US-10905666-B2 Methods and compositions for treating conditions associated with an abnormal inflammatory response FIRST WAVE BIO, INC. (US) 2021-02-02 US disclosed
US-10905665-B2 Chemical modulators of signaling pathways and therapeutic use DUKE UNIVERSITY (US) 2021-02-02 US disclosed
US-10905665-B2 Chemical modulators of signaling pathways and therapeutic use DUKE UNIVERSITY (US) 2021-02-02 US disclosed
US-8097759-B2 Inflammatory cytokine release inhibitor INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2012-01-17 US disclosed
US-20100274051-A1 INFLAMMATORY CYTOKINE RELEASE INHIBITOR INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2010-10-28 US disclosed
US-20090192122-A2 INFLAMMATORY CYTOKINE RELEASE INHIBITOR INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2009-07-30 US disclosed
US-20080318956-A1 INFLAMMATORY CYTOKINE RELEASE INHIBITOR INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2008-12-25 US disclosed
US-20080249071-A1 INFLAMMATORY CYTOKINE RELEASE INHIBITOR INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2008-10-09 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-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-20210401784-A1 METHODS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH AN ABNORMAL INFLAMMATORY RESPONSE FH, CS, ECHS1 KCNMA1 1478/4885P2RX1 910/4885TMPRSS4 2067/4885
US-20100274051-A1 INFLAMMATORY CYTOKINE RELEASE INHIBITOR IL1B, NFKBIA, IL1A KCNMA1 3082/4885P2RX1 1459/4885TMPRSS4 1813/4885
US-20090192122-A2 INFLAMMATORY CYTOKINE RELEASE INHIBITOR IL1B, NFKBIA, IL1A KCNMA1 3380/4885P2RX1 1538/4885TMPRSS4 1647/4885
US-20080249071-A1 INFLAMMATORY CYTOKINE RELEASE INHIBITOR IL1B, NFKBIA, IL1A KCNMA1 3380/4885P2RX1 1538/4885TMPRSS4 1647/4885
US-10912746-B2 Methods and compositions for treating conditions associated with an abnormal inflammatory response FH, CS, ECHS1 KCNMA1 1490/4885P2RX1 901/4885TMPRSS4 2073/4885
US-20200038350-A1 CHEMICAL MODULATORS OF SIGNALING PATHWAYS AND THERAPEUTIC USE SFRP1, FZD7, WNT1 KCNMA1 4847/4885P2RX1 3423/4885TMPRSS4 2074/4885
US-20080318956-A1 INFLAMMATORY CYTOKINE RELEASE INHIBITOR IL1B, NFKBIA, IL1A KCNMA1 3380/4885P2RX1 1538/4885TMPRSS4 1647/4885
US-20220000812-A1 METHODS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH AN ABNORMAL INFLAMMATORY RESPONSES FH, CS, ECHS1 KCNMA1 1417/4885P2RX1 848/4885TMPRSS4 2146/4885
US-10905665-B2 Chemical modulators of signaling pathways and therapeutic use SFRP1, FZD7, WNT1 KCNMA1 4847/4885P2RX1 3423/4885TMPRSS4 2074/4885
US-10905666-B2 Methods and compositions for treating conditions associated with an abnormal inflammatory response FH, CS, ECHS1 KCNMA1 1478/4885P2RX1 910/4885TMPRSS4 2067/4885
US-20040259877-A1 Inhibitors against the production and release of inflammatory cytokines NFKBIA, IL1B, IKBKB KCNMA1 2705/4885P2RX1 2316/4885TMPRSS4 3292/4885
US-11793777-B2 Methods and compositions for treating conditions associated with an abnormal inflammatory response FH, CS, ECHS1 KCNMA1 1478/4885P2RX1 910/4885TMPRSS4 2067/4885

“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.