SCHEMBL17594376

SCHEMBL17594376

Cc1c(-c2ccc(F)cc2)nc2ccc(Br)cc2c1C(=O)O

nearest known ligand 0.73

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 15/20 0.73
PTGFR P43088 4/20 0.67
DHFR P00374 1/20 0.65
ALKBH5 Q6P6C2 1/20 0.65
AURKA O14965 1/20 0.59
KDR P35968 1/20 0.59
AURKB Q96GD4 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
SCHEMBL5793184 0.94 DHODH (0.79) DHODHDHFRALKBH5
SCHEMBL8730770 0.92 DHODH (0.81) DHODHDHFRALKBH5
SCHEMBL18089100 0.90 PTGFR (0.64) DHODHPTGFRDHFRALKBH5
SCHEMBL23590030 0.89 DHODH (0.90) DHODHDHFRALKBH5
SCHEMBL29617666 0.89 DHODH (0.90) DHODHDHFRALKBH5
SCHEMBL14553160 0.88 DHODH (0.73) DHODHPTGFR
Hydrochloric Acid SCHEMBL28389865 0.86 DHODH (0.71) DHODHPTGFR
SCHEMBL2372361 0.86 DHODH (0.74) DHODHPTGFRAURKAKDRAURKB
SCHEMBL17593932 0.86 PTGFR (0.68) DHODHPTGFRDHFRALKBH5
SCHEMBL10580471 0.85 DHODH (0.76) DHODHPTGFRAURKAKDRAURKB

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10479765-B2 Substituted N,2-diarylquinoline-4-carboxamides and the use thereof as anti-inflammatory agents BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2019-11-19 US disclosed
US-10479765-B2 Substituted N,2-diarylquinoline-4-carboxamides and the use thereof as anti-inflammatory agents BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2019-11-19 US disclosed
US-10189788-B2 Substituted N,2-diarylquinoline-4-carboxamides and the use thereof as anti-inflammatory agents BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2019-01-29 US disclosed
US-10189788-B2 Substituted N,2-diarylquinoline-4-carboxamides and the use thereof as anti-inflammatory agents BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2019-01-29 US disclosed
US-20190002409-A1 SUBSTITUTED N,2-DIARYLQUINOLINE-4-CARBOXAMIDES AND THE USE THEREOF AS ANTI-INFLAMMATORY AGENTS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2019-01-03 US disclosed
US-20190002409-A1 SUBSTITUTED N,2-DIARYLQUINOLINE-4-CARBOXAMIDES AND THE USE THEREOF AS ANTI-INFLAMMATORY AGENTS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2019-01-03 US disclosed
US-10117864-B2 Substituted N-bicyclo-2-aryl-quinolin-4-carboxamides and use thereof BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-11-06 US disclosed
US-20180036300-A1 SUBSTITUTED N-BICYCLO-2-ARYL-QUINOLIN-4-CARBOXAMIDES AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-02-08 US disclosed
US-20180036300-A1 SUBSTITUTED N-BICYCLO-2-ARYL-QUINOLIN-4-CARBOXAMIDES AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-02-08 US disclosed
US-20180036300-A1 SUBSTITUTED N-BICYCLO-2-ARYL-QUINOLIN-4-CARBOXAMIDES AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-02-08 US disclosed
US-20170260140-A1 SUBSTITUTED N,2-DIARYLQUINOLINE-4-CARBOXAMIDES AND THE USE THEREOF AS ANTI-INFLAMMATORY AGENTS Bayer Pharma Aktiengesekkschaft (DE) 2017-09-14 US disclosed
US-20170260140-A1 SUBSTITUTED N,2-DIARYLQUINOLINE-4-CARBOXAMIDES AND THE USE THEREOF AS ANTI-INFLAMMATORY AGENTS Bayer Pharma Aktiengesekkschaft (DE) 2017-09-14 US disclosed
US-20170260140-A1 SUBSTITUTED N,2-DIARYLQUINOLINE-4-CARBOXAMIDES AND THE USE THEREOF AS ANTI-INFLAMMATORY AGENTS Bayer Pharma Aktiengesekkschaft (DE) 2017-09-14 US disclosed
EP-3191452-A1 SUBSTITUTED N,2-DIARYLQUINOLINE-4-CARBOXAMIDES AND THE USE THEREOF AS ANTI-INFLAMMATORY AGENTS Bayer Pharma Aktiengesellschaft (DE) 2017-07-19 EP disclosed
WO-2016146602-A1 SUBSTITUTED N-BICYCLO-2-ARYL-QUINOLIN-4-CARBOXAMIDES AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-09-22 WO disclosed
WO-2016037954-A1 SUBSTITUTED N,2-DIARYLQUINOLINE-4-CARBOXAMIDES AND THE USE THEREOF AS ANTI-INFLAMMATORY AGENTS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-03-17 WO 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 (6 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-10479765-B2 Substituted N,2-diarylquinoline-4-carboxamides and the use thereof as anti-inflammatory agents AADAC, NFKBIA, NOD2 DHODH 1976/4885PTGFR 749/4885DHFR 1184/4885
US-20170260140-A1 SUBSTITUTED N,2-DIARYLQUINOLINE-4-CARBOXAMIDES AND THE USE THEREOF AS ANTI-INFLAMMATORY AGENTS AADAC, NFKBIA, NOD2 DHODH 1976/4885PTGFR 749/4885DHFR 1184/4885
US-20190002409-A1 SUBSTITUTED N,2-DIARYLQUINOLINE-4-CARBOXAMIDES AND THE USE THEREOF AS ANTI-INFLAMMATORY AGENTS AADAC, NFKBIA, NOD2 DHODH 1976/4885PTGFR 749/4885DHFR 1184/4885
US-10117864-B2 Substituted N-bicyclo-2-aryl-quinolin-4-carboxamides and use thereof AADAC, BRD4, GOT2 DHODH 2475/4885PTGFR 1602/4885DHFR 1176/4885
US-20180036300-A1 SUBSTITUTED N-BICYCLO-2-ARYL-QUINOLIN-4-CARBOXAMIDES AND USE THEREOF AADAC, BRD4, GOT2 DHODH 2475/4885PTGFR 1602/4885DHFR 1176/4885
US-10189788-B2 Substituted N,2-diarylquinoline-4-carboxamides and the use thereof as anti-inflammatory agents AADAC, NFKBIA, NOD2 DHODH 1976/4885PTGFR 749/4885DHFR 1184/4885

“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.