SCHEMBL31663300

SCHEMBL31663300

Cc1nc(CN2CCC(C#CC(=O)C3C=NC4=COC=CN43)CC2)nc2ccccc12

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
OGA O60502 2/20 0.34
BCHE P06276 6/20 0.32
ACHE P22303 6/20 0.32
DPP4 P27487 9/20 0.31
FAP Q12884 3/20 0.31
KCNH2 Q12809 2/20 0.31

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
SCHEMBL31663032 0.76 OGA (0.33) OGABCHEACHEDPP4FAP
SCHEMBL31663181 0.73 OGA (0.36) OGAACHEDPP4FAP
SCHEMBL31663327 0.72 CYP2C9 (0.41) OGA
SCHEMBL31663115 0.70 OGA (0.36) OGADPP4FAP
SCHEMBL31663067 0.70 DPP4 (0.37) OGADPP4FAPKCNH2
SCHEMBL31662944 0.70 OGA (0.37) OGABCHEACHEDPP4FAP
SCHEMBL31662940 0.69 DPP4 (0.40) ACHEDPP4FAP
SCHEMBL31663276 0.68 MGLL (0.36) OGADPP4FAP
SCHEMBL31663310 0.67 MAPT (0.43) ACHE
SCHEMBL31663051 0.62

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
WO-2025149628-A1 PIPERIDINE DERIVATIVES AS INHIBITORS OF NICOTINAMIDE N-METHYL TRANSFERASE ASTRAZENECA AB (SE) 2025-07-17 WO disclosed