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SCHEMBL31479440

SCHEMBL31479440

CCN(C(=O)c1cc(F)ccc1-c1cc(C2CCN(CC3(O)CCC(NS(=O)(=O)CC)CC3)C2)cc2c1cnn2C)C(C)C

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 7/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ HTR2A P28223 11/20 0.35
▸ DRD3 P35462 1/20 0.35
▸ HTR7 P34969 9/20 0.32
▸ DRD2 P14416 4/20 0.32
▸ TRPV1 Q8NER1 1/20 0.30
▸ HCRTR1 O43613 1/20 0.30
▸ HCRTR2 O43614 1/20 0.30
▸ MAPK14 Q16539 1/20 0.30

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
SCHEMBL31479046 1.00 KCNH2 (0.42) KCNH2MEN1KMT2AHTR2ADRD3
SCHEMBL31479214 1.00 KCNH2 (0.42) KCNH2MEN1KMT2AHTR2ADRD3
SCHEMBL31479012 0.90 HTR2A (0.33) KCNH2MEN1KMT2AHTR2AHTR7
SCHEMBL31478938 0.90 HTR2A (0.33) KCNH2MEN1KMT2AHTR2AHTR7
SCHEMBL31479492 0.90 HTR2A (0.33) KCNH2MEN1KMT2AHTR2AHTR7
SCHEMBL31479895 0.89 KCNH2 (0.49) KCNH2MEN1KMT2AHTR2ADRD3
SCHEMBL31479690 0.88 MEN1 (0.34) KCNH2MEN1KMT2A
SCHEMBL31479694 0.88 MEN1 (0.34) KCNH2MEN1KMT2A
SCHEMBL31479073 0.88 MEN1 (0.34) KCNH2MEN1KMT2A
SCHEMBL31479339 0.86 MEN1 (0.44) KCNH2MEN1KMT2AHTR2ADRD3

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