SCHEMBL14980668

SCHEMBL14980668

CCc1sc(NC)c(C(=O)NC)c1CC(=O)O

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 1/20 0.38
▸ BRD4 O60885 1/20 0.34
▸ BRPF1 P55201 1/20 0.34
▸ EP300 Q09472 1/20 0.34
▸ CREBBP Q92793 1/20 0.34
▸ PLK1 P53350 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
SCHEMBL14980671 0.87 USP2 (0.37) USP2BRD4BRPF1EP300CREBBP
SCHEMBL15241099 0.64 TBXA2R (0.30) —
SCHEMBL14981143 0.62 USP2 (0.30) USP2
SCHEMBL13189445 0.59 APEX1 (0.38) —
SCHEMBL24415030 0.59 USP2 (0.42) USP2BRD4BRPF1EP300CREBBP
SCHEMBL9097369 0.57 ALDH1A1 (0.36) —
SCHEMBL29532612 0.56 GRIA2 (0.38) —
SCHEMBL10713707 0.55 ALDH1A1 (0.41) USP2
SCHEMBL9880895 0.54 HPGD (0.50) USP2
SCHEMBL11744319 0.52 AKR1B1 (0.42) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2411396-B1 THIENOPYRIMIDINEDIONE DERIVATIVES AS TRPA1 MODULATORS GLENMARK PHARMACEUTICALS SA (CH) 2013-05-29 — — EP disclosed
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