SCHEMBL31479110

SCHEMBL31479110

CCN(C(=O)c1cc(F)ccc1-c1cc([C@@H]2CCNC2)cc2c1cnn2C)C(C)C

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.35
SLC6A4 P31645 2/20 0.35
SLC6A3 Q01959 1/20 0.35
EZH2 Q15910 1/20 0.34
EZH1 Q92800 1/20 0.34
HCRTR1 O43613 6/20 0.34
HCRTR2 O43614 6/20 0.34
TRPV1 Q8NER1 1/20 0.33
AKT1 P31749 5/20 0.33
POLQ O75417 1/20 0.32
HTR2A P28223 1/20 0.32
HTR7 P34969 1/20 0.32
MAPK14 Q16539 2/20 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
SCHEMBL31479460 1.00 SLC6A2 (0.35) SLC6A2SLC6A4SLC6A3EZH2EZH1
SCHEMBL31479544 1.00 SLC6A2 (0.35) SLC6A2SLC6A4SLC6A3EZH2EZH1
SCHEMBL31479670 0.94 HCRTR1 (0.36) HCRTR1HCRTR2TRPV1HTR2AHTR7
SCHEMBL31479424 0.92 SLC6A2 (0.35) SLC6A2SLC6A4SLC6A3EZH2EZH1
SCHEMBL31479663 0.88 SLC6A2 (0.33) SLC6A2SLC6A4SLC6A3TRPV1MAPK14
SCHEMBL31478972 0.85 SSTR4 (0.33) SLC6A2SLC6A4SLC6A3HCRTR1HCRTR2
SCHEMBL31479447 0.85 HCRTR1 (0.34) SLC6A2SLC6A4SLC6A3HCRTR1HCRTR2
SCHEMBL31479852 0.83 GPBAR1 (0.40)
SCHEMBL31479636 0.83 HTR2A (0.32) HCRTR1HCRTR2HTR2AHTR7MAPK14
SCHEMBL31479308 0.80 HCRTR1 (0.39) HCRTR1HCRTR2

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