SCHEMBL31479845

SCHEMBL31479845

Cc1nc(F)c2c(-c3ccc(F)cc3C(=O)N(CC(F)F)C(C)C)cc(C3CN(C(=O)[C@@H]4CCCCN4C(=O)OC(C)(C)C)C3)cn12

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
WNT3 P56703 2/20 0.34
SFRP1 Q8N474 2/20 0.34
POLB P06746 1/20 0.33
GPBAR1 Q8TDU6 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
UCHL1 P09936 1/20 0.32
GPR119 Q8TDV5 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MC4R P32245 1/20 0.31
MC5R P33032 1/20 0.31
MC3R P41968 1/20 0.31
MC1R Q01726 1/20 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
SCHEMBL31479484 0.89 GPBAR1 (0.39) POLBGPBAR1GPR119
SCHEMBL31478976 0.83 TLR9 (0.31) MC4RMC5RMC3RMC1R
SCHEMBL31479332 0.83 GPBAR1 (0.38) POLBGPBAR1GPR119
SCHEMBL31479344 0.80 SLC6A2 (0.30)
SCHEMBL31478913 0.80 GPBAR1 (0.39) POLBGPBAR1GPR119
SCHEMBL31479318 0.80 PREP (0.37) POLBGPBAR1GPR119
SCHEMBL31479661 0.79 GPR119 (0.39) POLBGPR119
SCHEMBL31479738 0.79 GPR119 (0.39) POLBGPR119
SCHEMBL31479587 0.79 GPR119 (0.39) POLBGPBAR1GPR119
SCHEMBL31479192 0.79 GPR119 (0.39) POLBGPBAR1GPR119

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-2025067111-A1 MENIN-MLL INTERACTION INHIBITOR AND PREPARATION METHOD THEREFOR, AND APPLICATION 苏州必扬医药科技有限公司 2025-04-03 WO disclosed