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SCHEMBL31479478

SCHEMBL31479478

CCN(C(=O)c1cc(F)ccc1-c1cc(C2CNC2)cn2c(C)nnc12)C(C)C

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HCRTR1 O43613 13/20 0.37
▸ HCRTR2 O43614 13/20 0.37
▸ BRD4 O60885 5/20 0.32
▸ BRD2 P25440 5/20 0.32
▸ BRD3 Q15059 5/20 0.32
▸ CREBBP Q92793 4/20 0.32
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ KCNH2 Q12809 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
SCHEMBL31479898 0.94 HCRTR1 (0.36) HCRTR1HCRTR2BRD4BRD2BRD3
SCHEMBL31479417 0.86 HCRTR1 (0.37) HCRTR1HCRTR2MEN1KMT2AKCNH2
SCHEMBL31479549 0.86 HCRTR1 (0.35) HCRTR1HCRTR2MEN1KMT2AKCNH2
SCHEMBL31479226 0.85 HCRTR1 (0.35) HCRTR1HCRTR2KCNH2
SCHEMBL31479254 0.85 GPBAR1 (0.38) HCRTR1HCRTR2BRD4BRD3
SCHEMBL31479359 0.83 HCRTR1 (0.33) HCRTR1HCRTR2
SCHEMBL31479823 0.83 HCRTR1 (0.33) HCRTR1HCRTR2
SCHEMBL31479082 0.82 GPR119 (0.40) BRD4BRD3
SCHEMBL31478974 0.82 HCRTR1 (0.33) HCRTR1HCRTR2
SCHEMBL31479744 0.82 HCRTR1 (0.33) 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