SCHEMBL31479803

SCHEMBL31479803

CCN(C(=O)c1cc(F)ccc1-c1cc(C2CN([C@H](CN3C[C@@H](O)[C@H](O)C3)C(C)C)C2)cn2c(C)ncc12)C(C)C

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 4/20 0.34
HCRTR2 O43614 4/20 0.34
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
SCHEMBL31479893 1.00 HCRTR1 (0.34) HCRTR1HCRTR2MEN1KMT2AKCNH2
SCHEMBL31479748 0.92 HCRTR1 (0.35) HCRTR1HCRTR2MEN1KMT2AKCNH2
SCHEMBL31479414 0.92 HCRTR1 (0.35) HCRTR1HCRTR2MEN1KMT2AKCNH2
SCHEMBL31479105 0.91 HCRTR1 (0.33) HCRTR1HCRTR2MEN1KMT2AKCNH2
SCHEMBL31479570 0.91 HCRTR1 (0.33) HCRTR1HCRTR2MEN1KMT2AKCNH2
SCHEMBL31479686 0.91 HCRTR1 (0.33) HCRTR1HCRTR2MEN1KMT2AKCNH2
SCHEMBL31479321 0.91 HCRTR1 (0.34) HCRTR1HCRTR2MEN1KMT2AKCNH2
SCHEMBL31479715 0.91 HCRTR1 (0.34) HCRTR1HCRTR2MEN1KMT2AKCNH2
SCHEMBL31479233 0.90 HCRTR1 (0.33) HCRTR1HCRTR2MEN1KMT2AKCNH2
SCHEMBL31479605 0.90 HCRTR1 (0.33) HCRTR1HCRTR2MEN1KMT2AKCNH2

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