SCHEMBL7344659

SCHEMBL7344659

CC(C)(C)OC(=O)N1CCC(n2nc(S(C)(=O)=O)c3cc(Br)ccc32)CC1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 13/20 0.53
▸ CYP3A4 P08684 2/20 0.45
▸ CYP2C9 P11712 1/20 0.44
▸ FPR2 P25090 1/20 0.44
▸ USP30 Q70CQ3 1/20 0.41
▸ NR3C1 P04150 1/20 0.41

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
SCHEMBL7350998 0.86 GPR119 (0.39) GPR119CYP3A4CYP2C9
SCHEMBL27496528 0.85 GPR119 (0.37) GPR119CYP3A4CYP2C9
SCHEMBL8820197 0.84 GPR119 (0.46) GPR119CYP3A4FPR2USP30NR3C1
SCHEMBL8818888 0.82 GPR119 (0.44) GPR119FPR2USP30
SCHEMBL31583380 0.82 GPR119 (0.44) GPR119FPR2USP30NR3C1
SCHEMBL7350588 0.82 GPR119 (0.49) GPR119CYP3A4CYP2C9FPR2USP30
SCHEMBL15656816 0.82 GPR119 (0.44) GPR119CYP3A4FPR2USP30NR3C1
SCHEMBL27497857 0.81 GPR119 (0.35) GPR119
SCHEMBL27498178 0.79 NSD3 (0.36) CYP3A4
SCHEMBL31565579 0.79 GPR119 (0.48) GPR119USP30NR3C1

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
EP-0912555-A1 PIPERIDINE ACETIC ACID DERIVATIVES AND THEIR USE IN THE TREATMENT OF THROMBOTIC DISORDERS GLAXO GROUP LIMITED (GB) 1999-05-06 — — EP disclosed
WO-1997049699-A1 PIPERIDINE ACETIC ACID DERIVATIVES AND THEIR USE IN THE TREATMENT OF THROMBOTIC DISORDERS GLAXO GROUP LIMITED (GB) 1997-12-31 — — WO disclosed
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