SCHEMBL31272773

SCHEMBL31272773

CCCc1ccc2cc(C(=O)O)c(=O)[nH]c2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DAO P14920 1/20 0.51
▸ KDM4E B2RXH2 2/20 0.48
▸ GAA P10253 2/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ POLB P06746 1/20 0.48
▸ CNR2 P34972 1/20 0.44
▸ MCL1 Q07820 1/20 0.43
▸ GRIK1 P39086 1/20 0.41
▸ GRIA1 P42261 1/20 0.41
▸ GRIA2 P42262 1/20 0.41
▸ GRIA3 P42263 1/20 0.41
▸ GRIA4 P48058 1/20 0.41
▸ GRIK2 Q13002 1/20 0.41
▸ GRIK3 Q13003 1/20 0.41
▸ HPGD P15428 2/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ KAT8 Q9H7Z6 2/20 0.40
▸ PPARA Q07869 1/20 0.40
▸ METAP2 P50579 1/20 0.40
▸ SORT1 Q99523 1/20 0.40

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
SCHEMBL31273131 0.85 DAO (0.51) DAOKDM4EGAAALDH1A1POLB
SCHEMBL31423270 0.84 ALDH1A1 (0.52) DAOKDM4EGAAALDH1A1POLB
SCHEMBL31273184 0.80 DAO (0.49) DAOKDM4EALDH1A1CNR2HSD17B10
SCHEMBL10330642 0.77 DAO (0.63) DAOKDM4EGAAALDH1A1POLB
SCHEMBL31222324 0.77 KDM4E (0.61) DAOKDM4EGAAALDH1A1POLB
SCHEMBL25427065 0.76 ALDH1A1 (0.56) DAOKDM4EGAAALDH1A1POLB
SCHEMBL30529281 0.76 ALDH1A1 (0.56) DAOKDM4EGAAALDH1A1POLB
SCHEMBL29415463 0.75 CASP3 (0.55) KDM4EGAAALDH1A1POLBGRIK1
SCHEMBL2807085 0.75 CASP3 (0.55) KDM4EGAAALDH1A1POLBGRIK1
SCHEMBL27840670 0.75 KDM4E (0.51) DAOKDM4EGAAALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025085233-A1 NOVEL DERIVATIVES OF QUINOLINONES, AND COMPOSITIONS AND METHODS THEREOF ENSEM THERAPEUTICS, INC. (US) 2025-04-24 — — WO disclosed
CN-119101045-A Nitrogen-containing heterocyclic compounds, and preparation method and application thereof 上海宇道生物技术有限公司 2024-12-10 — — CN disclosed
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