SCHEMBL30487433

SCHEMBL30487433

Cc1cc(N2CCc3cc(F)ccc3C2)cc(C2(F)CC2)c1C(C(N)=O)C(C)(C)C

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KCNQ2 O43526 5/20 0.53
▸ DPP9 Q86TI2 10/20 0.42
▸ DPP8 Q6V1X1 8/20 0.42
▸ DPP4 P27487 5/20 0.42
▸ DPP7 Q9UHL4 5/20 0.42
▸ PITRM1 Q5JRX3 1/20 0.39
▸ MAOB P27338 1/20 0.34
▸ SCN9A Q15858 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
SCHEMBL30577022 0.90 KCNQ2 (0.60) KCNQ2DPP9DPP8DPP4DPP7
SCHEMBL26661822 0.90 KCNQ2 (0.60) KCNQ2DPP9DPP8DPP4DPP7
SCHEMBL38659467 0.84 KCNQ2 (0.56) KCNQ2DPP9DPP8DPP4DPP7
SCHEMBL31546568 0.83 KCNQ2 (0.48) KCNQ2DPP9DPP8DPP4DPP7
SCHEMBL31546531 0.83 KCNQ2 (0.48) KCNQ2DPP9DPP8DPP4DPP7
SCHEMBL38659319 0.83 KCNQ2 (0.55) KCNQ2DPP9DPP8DPP4DPP7
SCHEMBL31020139 0.82 KCNQ2 (0.52) KCNQ2DPP9DPP8DPP4DPP7
SCHEMBL38660352 0.81 KCNQ2 (0.50) KCNQ2DPP9DPP8DPP4DPP7
SCHEMBL31519813 0.81 KCNQ2 (0.45) KCNQ2DPP9DPP8DPP4DPP7
SCHEMBL38660003 0.80 KCNQ2 (0.48) KCNQ2DPP9DPP8DPP4DPP7

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
CN-119948023-A Regulator containing piperidine polycyclic derivative, preparation method and application thereof 上海翰森生物医药科技有限公司 2025-05-06 — — CN disclosed
CN-118451079-A Benzopiperidine derivative modulators, methods of preparation and uses thereof 上海翰森生物医药科技有限公司 2024-08-06 — — CN disclosed
WO-2023125935-A1 BENZOPYRIDINE DERIVATIVE REGULATOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海翰森生物医药科技有限公司 2023-07-06 — — WO disclosed
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