SCHEMBL31479161

SCHEMBL31479161

Cn1ncc2c(-c3ccc(F)cc3C(=O)O)cc(C3CCCN(C(=O)OC(C)(C)C)C3)cc21

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.46
ALOX5AP P20292 2/20 0.40
FEN1 P39748 2/20 0.40
POLB P06746 1/20 0.40
HPGDS O60760 1/20 0.40
TP53 P04637 3/20 0.38
PRMT5 O14744 1/20 0.38
SCN9A Q15858 1/20 0.38
BCL9 O00512 1/20 0.38
CTNNB1 P35222 1/20 0.38
MAPT P10636 1/20 0.37
MEN1 O00255 1/20 0.37
USP2 O75604 1/20 0.37
HPGD P15428 1/20 0.37
KMT2A Q03164 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL31478953 0.96 SMN1; SMN2 (0.50) SMN1; SMN2POLBTP53MAPTMEN1
SCHEMBL31479750 0.93 SMN1; SMN2 (0.45) SMN1; SMN2ALOX5APFEN1POLBTP53
SCHEMBL31479246 0.90 POLB (0.41) SMN1; SMN2ALOX5APFEN1POLBHPGDS
SCHEMBL31479791 0.86 ALOX5AP (0.39) SMN1; SMN2ALOX5APFEN1POLBHPGDS
SCHEMBL31479761 0.86 TP53 (0.45) SMN1; SMN2POLBTP53MEN1HPGD
SCHEMBL31479262 0.83 GPR119 (0.39) SMN1; SMN2ALOX5APFEN1POLBTP53
SCHEMBL31479320 0.83 GPR119 (0.39) SMN1; SMN2ALOX5APFEN1POLBTP53
SCHEMBL31479837 0.83 GPR119 (0.39) SMN1; SMN2ALOX5APFEN1POLBTP53
SCHEMBL31479136 0.82 GPR119 (0.39) SMN1; SMN2ALOX5APFEN1POLBTP53
SCHEMBL31479724 0.82 POLB (0.40) SMN1; SMN2ALOX5APFEN1POLBTP53

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