SCHEMBL19971415

SCHEMBL19971415

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

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.49
NFE2L2 Q16236 1/20 0.49
CASP1 P29466 1/20 0.33
KDM4E B2RXH2 5/20 0.32
ALDH1A1 P00352 4/20 0.32
HPGD P15428 4/20 0.32
HSD17B10 Q99714 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
NPC1 O15118 1/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
TSHR P16473 2/20 0.32
CTNNB1 P35222 1/20 0.32
TCF7L2 Q9NQB0 1/20 0.32
JMJD6 Q6NYC1 1/20 0.31
POLB P06746 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
RXFP1 Q9HBX9 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 1.00 KEAP1 (0.49) KEAP1NFE2L2CASP1KDM4EALDH1A1
SCHEMBL19971460 0.87 CASP1 (0.34) KEAP1NFE2L2CASP1KDM4EALDH1A1
SCHEMBL10838807 0.82 CYP1A2 (0.35) ALDH1A1HPGDSMN1; SMN2MAPTTSHR
SCHEMBL5533193 0.81 GPR35 (0.32) ALDH1A1MAPT
SCHEMBL13108209 0.78 KEAP1 (0.46) KEAP1NFE2L2CASP1KDM4EALDH1A1
SCHEMBL860929 0.77 KEAP1 (0.57) KEAP1NFE2L2CASP1KDM4EALDH1A1
SCHEMBL3694141 0.77 OPRK1 (0.37) KDM4EALDH1A1HSD17B10SMN1; SMN2NPC1
SCHEMBL3694144 0.77 OPRK1 (0.37) KDM4EALDH1A1HSD17B10SMN1; SMN2NPC1
SCHEMBL14600962 0.76 KEAP1 (0.47) KEAP1NFE2L2CASP1KDM4EALDH1A1
SCHEMBL10422335 0.75 MAPT (0.36) ALDH1A1HPGDSMN1; SMN2NPC1MAPT

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