SCHEMBL31479708

SCHEMBL31479708

CCN(C(=O)c1cc(F)ccc1-c1cc(C2CN([C@H](CCCN3CCC(OC)CC3)C(C)C)C2)cc2c1cnn2C)C(C)C

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 17/20 0.35
DRD2 P14416 11/20 0.35
HTR7 P34969 15/20 0.35
KCNH2 Q12809 10/20 0.33
MAPK14 Q16539 1/20 0.32

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
SCHEMBL31479272 1.00 HTR2A (0.35) HTR2ADRD2HTR7KCNH2MAPK14
SCHEMBL31479697 0.91 HTR2A (0.34) HTR2ADRD2HTR7KCNH2
SCHEMBL31479416 0.91 HTR2A (0.34) HTR2ADRD2HTR7KCNH2
SCHEMBL31479225 0.89 HTR2A (0.33) HTR2ADRD2HTR7KCNH2
SCHEMBL31479002 0.85 HTR2A (0.32) HTR2ADRD2HTR7KCNH2MAPK14
SCHEMBL31479627 0.85 HTR2A (0.34) HTR2ADRD2HTR7KCNH2
SCHEMBL31479316 0.85 HTR2A (0.34) HTR2ADRD2HTR7KCNH2
SCHEMBL31479721 0.85 HCRTR1 (0.34) HTR2ADRD2HTR7KCNH2MAPK14
SCHEMBL31479175 0.85 HCRTR1 (0.34) HTR2ADRD2HTR7KCNH2MAPK14
SCHEMBL31479671 0.84 HCRTR1 (0.32) MAPK14

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