SCHEMBL31479377

SCHEMBL31479377

CC(C)[C@@H](CN1CCN(C(=O)OC(C)(C)C)CC1)N1CC(c2cc(Cl)c3cnn(C)c3c2)C1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 3/20 0.35
NR3C1 P04150 1/20 0.35
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
MAPK1 P28482 1/20 0.35
HTT P42858 1/20 0.35
RAB9A P51151 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
RXFP1 Q9HBX9 1/20 0.34
TP53 P04637 1/20 0.34
THRB P10828 1/20 0.34
LMNA P02545 1/20 0.34
ADORA2A P29274 1/20 0.34
BCDIN3D Q7Z5W3 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
SCHEMBL31479850 1.00 CNR1 (0.35) CNR1NR3C1CHRM2CHRM4CHRM1
SCHEMBL31479309 1.00 CNR1 (0.35) CNR1NR3C1CHRM2CHRM4CHRM1
SCHEMBL31479444 0.82 TP53 (0.38) MAPTRXFP1TP53LMNABCDIN3D
SCHEMBL31479235 0.79 PLK1 (0.34) MAPTTP53THRBLMNA
SCHEMBL31479562 0.79 PLK1 (0.34) MAPTTP53THRBLMNA
SCHEMBL31479167 0.73 THRB (0.36) CNR1NPC1ALDH1A1MAPTMAPK1
SCHEMBL31479858 0.73 THRB (0.36) CNR1NPC1ALDH1A1MAPTMAPK1
SCHEMBL31479759 0.72 GLP1R (0.34)
SCHEMBL31479707 0.72 GLP1R (0.34)
SCHEMBL31479504 0.72 GLP1R (0.34)

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