SCHEMBL7526744

SCHEMBL7526744

Cc1cc(F)c(Cl)nc1Cl

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.47
NFE2L2 Q16236 1/20 0.47
ALDH1A1 P00352 2/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
POLB P06746 1/20 0.32
KHK P50053 1/20 0.31
KMT2A Q03164 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL9321491 0.83 KEAP1 (0.41) KEAP1NFE2L2ALDH1A1MAPK1SMN1; SMN2
SCHEMBL29260193 0.81 KEAP1 (0.56) KEAP1NFE2L2KHK
SCHEMBL25036382 0.76 GLP1R (0.34)
SCHEMBL12090788 0.76 PIK3CA (0.34) ALDH1A1POLBKMT2ACYP1A2
SCHEMBL23673393 0.74 ALDH1A1 (0.33) KEAP1NFE2L2ALDH1A1MAPK1SMN1; SMN2
SCHEMBL23673396 0.74 ERBB2 (0.33) KEAP1NFE2L2
SCHEMBL23694779 0.74 CYP1A2 (0.40) KEAP1NFE2L2ALDH1A1MAPK1SMN1; SMN2
SCHEMBL2561658 0.74 ALDH1A1 (0.35) ALDH1A1MAPK1SMN1; SMN2POLBKMT2A
SCHEMBL6222738 0.74 KEAP1 (0.50) KEAP1NFE2L2KHKKMT2A
SCHEMBL20303036 0.73 SMN1; SMN2 (0.38) KEAP1NFE2L2ALDH1A1MAPK1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0187376-A2 6,7-Disubstituted 1-cyclopropyl-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylic acids BAYER AG (DE) 1986-07-16 EP claimed
EP-4273135-A1 PLASMIN INHIBITOR, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Scinnohub Pharmaceutical Co., Ltd (CN) 2023-11-08 EP disclosed
US-9932346-B2 Pyrrolopyrimidines for use in influenza virus infection JANSSEN SCIENCES IRELAND UC (IE) 2018-04-03 US disclosed
US-20170253600-A1 PYRROLOPYRIMIDINES FOR USE IN INFLUENZA VIRUS INFECTION JANSSEN INFECTIOUS DISEASES BVBA (BE) 2017-09-07 US disclosed
US-20170226102-A1 INDOLES FOR USE IN INFLUENZA VIRUS INFECTION JANSSEN INFECTIOUS DISEASES BVBA (BE) 2017-08-10 US disclosed
US-9650375-B2 Indole derivatives useful as anti-diabetic agents MERCK SHARP & DOHME CORP. (US) 2017-05-16 US disclosed
US-8367831-B2 Heterocyclic compound or salt thereof and intermediate thereof TOYAMA CHEMICAL CO., LTD. (JP) 2013-02-05 US disclosed
US-20120226035-A1 NOVEL HETEROCYCLIC COMPOUND OR SALT THEREOF AND INTERMEDIATE THEREOF TAISHO PHARMACEUTICAL CO., LTD. (JP) 2012-09-06 US disclosed
EP-1807421-B1 2-AMIDO-4-PHENYLTHIAZOLE DERIVATIVES, THE PREPARATION AND THE THERAPEUTIC USE THEREOF SANOFI AVENTIS (FR) 2011-03-16 EP disclosed
US-7842671-B1 Peptidomimetic inhibitors of STAT activity and uses thereof UNIVERSITY OF SOUTH FLORIDA (US) 2010-11-30 US disclosed
US-20070225282-A1 PYRIDINES AND PYRIDINE N-OXIDES AS MODULATORS OF THROMBIN JANSSEN PHARMACEUTICA, N.V. (BE) 2007-09-27 US disclosed
EP-1192138-A1 METHOD FOR THE PRODUCTION OF 2,6-DICHLORO-5-FLUORO-NICOTINIC ACID AND COARSE AND PARTICULARLY PURE 2,6-DICHLORO-5-FLUORO-NICOTINIC ACID Bayer Aktiengesellschaft (DE) 2002-04-03 EP disclosed
WO-2000076978-A1 METHOD FOR THE PRODUCTION OF 2,6-DICHLORO-5-FLUORO-NICOTINIC ACID AND COARSE AND PARTICULARLY PURE 2,6-DICHLORO-5-FLUORO-NICOTINIC ACID BAYER AKTIENGESELLSCHAFT (DE) 2000-12-21 WO disclosed
US-5334724-A Preparation of substituted 2-chloropyridines BAYER AKTIENGESELLSCHAFT (DE) 1994-08-02 US disclosed
EP-0438691-B1 Process for the preparation of substituted 2-chloropyridines BAYER AG (DE) 1994-02-16 EP disclosed
EP-0187376-B1 6,7-DISUBSTITUTED 1-CYCLOPROPYL-1,4-DIHYDRO-4-OXO-1,8-NAPHTHYRIDINE-3-CARBOXYLIC ACIDS BAYER AG (DE) 1992-05-13 EP disclosed
EP-0438691-A1 Process for the preparation of substituted 2-chloropyridines BAYER AG (DE) 1991-07-31 EP disclosed
EP-0333020-A2 Process for the preparation of substituted pyridines ABBOTT LABORATORIES (US) 1989-09-20 EP disclosed
US-4840954-A BACTERICIDE BAYER AKTIENGESELLSCHAFT (DE) 1989-06-20 US disclosed
EP-0187376-A2 6,7-Disubstituted 1-cyclopropyl-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylic acids BAYER AG (DE) 1986-07-16 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 (4 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-20070225282-A1 PYRIDINES AND PYRIDINE N-OXIDES AS MODULATORS OF THROMBIN F2, F11, TBXAS1 KEAP1 1054/4885NFE2L2 742/4885ALDH1A1 3141/4885
US-20170226102-A1 INDOLES FOR USE IN INFLUENZA VIRUS INFECTION IDO1, IDO2, INMT KEAP1 1948/4885NFE2L2 1440/4885ALDH1A1 143/4885
US-20170253600-A1 PYRROLOPYRIMIDINES FOR USE IN INFLUENZA VIRUS INFECTION IMPDH1, IMPDH2, TYMP KEAP1 2951/4885NFE2L2 2084/4885ALDH1A1 211/4885
US-20120226035-A1 NOVEL HETEROCYCLIC COMPOUND OR SALT THEREOF AND INTERMEDIATE THEREOF IKZF3, ZC3HAV1L, CXXC5 KEAP1 853/4885NFE2L2 1532/4885ALDH1A1 3409/4885

“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.