SCHEMBL31575321

SCHEMBL31575321

C[C@H](c1ccc(F)cc1)C(C(N)=O)[C@H]1CCCN1C

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 3/20 0.46
DPP9 Q86TI2 3/20 0.46
DPP7 Q9UHL4 3/20 0.46
KCNH2 Q12809 2/20 0.46
DPP8 Q6V1X1 2/20 0.46
CHRNB4 P30926 4/20 0.39
CHRNA3 P32297 4/20 0.39
CACNA1B Q00975 2/20 0.38
OPRM1 P35372 1/20 0.38

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
SCHEMBL31575334 1.00 DPP4 (0.46) DPP4DPP9DPP7KCNH2DPP8
SCHEMBL31575342 0.96 DPP4 (0.45) DPP4DPP9DPP7KCNH2DPP8
SCHEMBL31575348 0.87 CHRNB2 (0.43) DPP4DPP7CHRNB4CHRNA3
SCHEMBL31575359 0.87 CHRNB2 (0.43) DPP4DPP7CHRNB4CHRNA3
SCHEMBL31575328 0.84 SLC6A2 (0.44) DPP4DPP7
SCHEMBL30166180 0.84 SLC6A2 (0.44) DPP4DPP7
SCHEMBL31575346 0.79 SMN1; SMN2 (0.40) DPP4CHRNB4CHRNA3
SCHEMBL7870941 0.78 SLC6A3 (0.46) CHRNB4CHRNA3
SCHEMBL14193555 0.76 CHRNB4 (0.41) CHRNB4CHRNA3
SCHEMBL26723785 0.75 HTR2A (0.47) CHRNB4CHRNA3

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
CN-115380030-B N-heteroarylalkyl-2- (heterocyclyl and heterocyclylmethyl) acetamide derivatives as SSTR4 agonists 武田药品工业株式会社 2025-05-16 CN disclosed