SCHEMBL19971460

SCHEMBL19971460

CCO/C(CC)=C(\C(=O)O)C(=O)c1cc(Cl)c(Cl)nc1Cl

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 1/20 0.34
KDM4E B2RXH2 4/20 0.33
ALDH1A1 P00352 4/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
HPGD P15428 2/20 0.33
HSD17B10 Q99714 1/20 0.33
GLP1R P43220 1/20 0.32
TSHR P16473 1/20 0.32
CYP4F2 P78329 1/20 0.32
CYP4A11 Q02928 1/20 0.32
BAZ2B Q9UIF8 1/20 0.32
BAZ2A Q9UIF9 1/20 0.32
KEAP1 Q14145 1/20 0.32
NFE2L2 Q16236 1/20 0.32
TDP1 Q9NUW8 3/20 0.31
MAPT P10636 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.30
MAPK1 P28482 2/20 0.30
POLB P06746 1/20 0.30

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
SCHEMBL6221426 0.87 KEAP1 (0.49) CASP1KDM4EALDH1A1SMN1; SMN2HPGD
SCHEMBL19971415 0.87 KEAP1 (0.49) CASP1KDM4EALDH1A1SMN1; SMN2HPGD
SCHEMBL3694144 0.79 OPRK1 (0.37) KDM4EALDH1A1SMN1; SMN2HSD17B10TSHR
SCHEMBL3694141 0.79 OPRK1 (0.37) KDM4EALDH1A1SMN1; SMN2HSD17B10TSHR
SCHEMBL10838807 0.76 CYP1A2 (0.35) ALDH1A1SMN1; SMN2HPGDTSHRCYP4F2
SCHEMBL5533193 0.73 GPR35 (0.32) ALDH1A1MAPT
SCHEMBL21174014 0.72 KEAP1 (0.33) ALDH1A1SMN1; SMN2HSD17B10GLP1RTSHR
SCHEMBL29457333 0.71 NPSR1 (0.36) CASP1KDM4EALDH1A1SMN1; SMN2HPGD
SCHEMBL29457332 0.71 NPSR1 (0.36) CASP1KDM4EALDH1A1SMN1; SMN2HPGD
SCHEMBL19987096 0.71 NPSR1 (0.36) CASP1KDM4EALDH1A1SMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3512849-B1 7-SUBSTITUTED 1-ARYL-NAPHTHYRIDIN-3-CARBOXAMIDES AND THEIR USE BAYER AG (DE) 2021-06-23 EP disclosed
EP-3512849-A1 7-SUBSTITUTED 1-ARYL-NAPHTHYRIDINE-3-CARBOXYLIC ACID AMIDES AND USE THEREOF Bayer Aktiengesellschaft (DE) 2019-07-24 EP disclosed
WO-2018050510-A1 7-SUBSTITUTED 1-ARYL-NAPHTHYRIDINE-3-CARBOXYLIC ACID AMIDES AND USE THEREOF BAYER AKTIENGESELLSCHAFT (DE) 2018-03-22 WO disclosed
EP-3296298-A1 7-SUBSTITUTED 1-ARYL-NAPHTHYRIDIN-3-CARBOXAMIDES AND THEIR USE Bayer Pharma Aktiengesellschaft (DE) 2018-03-21 EP disclosed