SCHEMBL9096468

SCHEMBL9096468

CC(C(=O)O)(c1ccccc1)n1c(=O)ccc2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.46
▸ BRD4 O60885 1/20 0.46
▸ BRPF1 P55201 1/20 0.46
▸ CA9 Q16790 1/20 0.46
▸ KAT2B Q92831 1/20 0.46
▸ BRD9 Q9H8M2 1/20 0.46
▸ KMT2A Q03164 3/20 0.40
▸ MAPT P10636 2/20 0.40
▸ NOTUM Q6P988 1/20 0.37
▸ CYP2C19 P33261 1/20 0.35
▸ HIF1A Q16665 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ MCL1 Q07820 1/20 0.35
▸ CHRM3 P20309 2/20 0.34
▸ MAP3K5 Q99683 1/20 0.34
▸ CYP1A2 P05177 2/20 0.34
▸ HDAC3 O15379 1/20 0.34
▸ HDAC4 P56524 1/20 0.34

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
SCHEMBL847600 0.78 CA12 (0.57) CA12BRD4BRPF1CA9KAT2B
SCHEMBL1052785 0.72 CA12 (0.53) CA12BRD4BRPF1CA9KAT2B
SCHEMBL29941678 0.72 CA12 (0.53) CA12BRD4BRPF1CA9KAT2B
Bicarbonate SCHEMBL10970799 0.69 BRPF1 (0.85) CA12BRD4BRPF1CA9KAT2B
SCHEMBL30887024 0.69 PPARG (0.37) KMT2AMAPTCYP2C19HIF1ACYP1A2
SCHEMBL30887023 0.69 PPARG (0.37) KMT2AMAPTCYP2C19HIF1ACYP1A2
SCHEMBL7592805 0.68 CHRM3 (0.57) CHRM3
SCHEMBL27888039 0.67 MAPT (0.64) KMT2AMAPTCYP2C19HIF1ATSHR
SCHEMBL6581393 0.67 CA12 (0.52) CA12BRD4BRPF1CA9KAT2B
SCHEMBL2127676 0.67 CYP2B6 (0.59) CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-8003139-A — — None — — JP disclosed
JP-H083139-A 2-OXO-1-QUINOLINYLMETHYLPHENYLACETIC ACID DERIVATIVE BAYER AG 1996-01-09 — — JP disclosed
EP-0608709-A1 2-Oxo-quinolin-1-yl-methyl-phenylacetic acid derivatives as angiotensin II Antagonists BAYER AG (DE) 1994-08-03 — — EP disclosed
Send feedback