SCHEMBL2837571

SCHEMBL2837571

Cc1cc(Cl)c([N+](=O)[O-])cc1O

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.62
CYP3A4 P08684 1/20 0.62
GPR35 Q9HC97 4/20 0.47
CXCR2 P25025 2/20 0.46
TSHR P16473 1/20 0.46
MAPK1 P28482 1/20 0.46
VCAM1 P19320 3/20 0.44
SNCA P37840 1/20 0.44
ALOX15 P16050 1/20 0.42
ALOX12 P18054 1/20 0.42
PPIA P62937 1/20 0.41
PGK1 P00558 1/20 0.41

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
SCHEMBL810599 0.92 ALDH1A1 (0.58) ALDH1A1CYP3A4GPR35CXCR2TSHR
SCHEMBL9867829 0.85 ALDH1A1 (0.53) ALDH1A1CYP3A4GPR35TSHRMAPK1
SCHEMBL68172 0.84 ALDH1A1 (0.71) ALDH1A1CYP3A4GPR35CXCR2TSHR
SCHEMBL4368022 0.84 GPR35 (0.54) ALDH1A1CYP3A4GPR35TSHRMAPK1
SCHEMBL31592017 0.84 TSHR (0.52) ALDH1A1CYP3A4GPR35TSHRMAPK1
SCHEMBL3633645 0.84 TSHR (0.52) ALDH1A1CYP3A4GPR35TSHRMAPK1
SCHEMBL2565885 0.82 ALDH1A1 (0.69) ALDH1A1CYP3A4GPR35CXCR2TSHR
SCHEMBL10266188 0.82 GPR35 (0.52) ALDH1A1CYP3A4GPR35TSHRMAPK1
SCHEMBL11555308 0.82 ALDH1A1 (0.69) ALDH1A1CYP3A4GPR35CXCR2TSHR
SCHEMBL1626324 0.82 TSHR (0.50) ALDH1A1CYP3A4GPR35TSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0342532-B1 PROCESS FOR THE PREPARATION OF 4-CHLORO-2-METHYL-5-NITRO-PHENOL Wella Aktiengesellschaft (DE) 1993-01-07 EP claimed
US-4960955-A Process for making 4-chloro-2-methyl-5-nitro-phenol WELLA AKTIENGESELLSCHAFT (DE) 1990-10-02 US claimed
EP-0211238-B1 AMINOPHENOLS AND THEIR USE AS OXIDATION HAIR DYEING AGENTS Henkel Kommanditgesellschaft auf Aktien (DE) 1990-04-04 EP claimed
EP-0342532-A1 Process for the preparation of 4-chloro-2-methyl-5-nitro-phenol Wella Aktiengesellschaft (DE) 1989-11-23 EP claimed
EP-0211238-A1 Aminophenols and their use as oxidation hair dyeing agents Henkel Kommanditgesellschaft auf Aktien (DE) 1987-02-25 EP claimed
US-20150041734-A1 POLARIZING FILM, IMAGE DISPLAY, AND METHOD FOR PRODUCING POLARIZING FILM NITTO DENKO CORPORATION (JP) 2015-02-12 US disclosed
CN-101233131-B Macrocyclic inhibitors of hepatitis c virus TIBOTEC PHARM LTD 2011-06-08 CN disclosed
US-7659245-B2 Macrocylic inhibitors of hepatitis C virus TIBOTEC PHARMACEUTICALS LTD (IE) 2010-02-09 US disclosed
US-7659245-B2 Macrocylic inhibitors of hepatitis C virus TIBOTEC PHARMACEUTICALS LTD (IE) 2010-02-09 US disclosed
US-7659245-B2 Macrocylic inhibitors of hepatitis C virus TIBOTEC PHARMACEUTICALS LTD (IE) 2010-02-09 US disclosed
US-7655688-B2 Treating nuclear hormone receptor-associated conditions such as cancer and immune disorders; (3a alpha ,4 alpha ,7 alpha ,7a alpha )-2-(3-Chloro-4-hydroxyphenyl)hexahydro-4,7-methano-1H-isoindole-1,3(2H)-dione BRISTOL-MYERS SQUIBB COMPANY (US) 2010-02-02 US disclosed
US-7655688-B2 Treating nuclear hormone receptor-associated conditions such as cancer and immune disorders; (3a alpha ,4 alpha ,7 alpha ,7a alpha )-2-(3-Chloro-4-hydroxyphenyl)hexahydro-4,7-methano-1H-isoindole-1,3(2H)-dione BRISTOL-MYERS SQUIBB COMPANY (US) 2010-02-02 US disclosed
EP-0211238-B1 AMINOPHENOLS AND THEIR USE AS OXIDATION HAIR DYEING AGENTS Henkel Kommanditgesellschaft auf Aktien (DE) 1990-04-04 EP disclosed
EP-0342532-A1 Process for the preparation of 4-chloro-2-methyl-5-nitro-phenol Wella Aktiengesellschaft (DE) 1989-11-23 EP disclosed
EP-0342532-A1 Process for the preparation of 4-chloro-2-methyl-5-nitro-phenol Wella Aktiengesellschaft (DE) 1989-11-23 EP disclosed
EP-0342532-A1 Process for the preparation of 4-chloro-2-methyl-5-nitro-phenol Wella Aktiengesellschaft (DE) 1989-11-23 EP disclosed
US-4863942-A Novel resorcinol ethers and anti-inflammatory and anti-allergic use thereof CIBA-GEIGY CORPORATION (US) 1989-09-05 US disclosed
EP-0165897-B1 RESORCIN ETHERS CIBA-GEIGY AG (CH) 1989-03-15 EP disclosed
EP-0211238-A1 Aminophenols and their use as oxidation hair dyeing agents Henkel Kommanditgesellschaft auf Aktien (DE) 1987-02-25 EP disclosed
EP-0165897-A2 Resorcin ethers CIBA-GEIGY AG (CH) 1985-12-27 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 (1 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-20150041734-A1 POLARIZING FILM, IMAGE DISPLAY, AND METHOD FOR PRODUCING POLARIZING FILM PYM1, H1-0, CHRM1 ALDH1A1 2833/4885CYP3A4 1349/4885GPR35 1627/4885

“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.