SCHEMBL31479036

SCHEMBL31479036

CCN(C(=O)c1cc(F)ccc1-c1cc([C@@H]2CCN(CC3CCC(N)CC3)C2)cc2cncn12)C(C)C

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 5/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ACKR3 P25106 11/20 0.36
HTR2A P28223 5/20 0.33
HTR7 P34969 4/20 0.33
DRD2 P14416 3/20 0.33

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
SCHEMBL31479396 1.00 KCNH2 (0.39) KCNH2MEN1KMT2AACKR3HTR2A
SCHEMBL31479556 1.00 KCNH2 (0.39) KCNH2MEN1KMT2AACKR3HTR2A
SCHEMBL31479276 0.90 MEN1 (0.51) KCNH2MEN1KMT2AACKR3HTR2A
SCHEMBL31479432 0.90 MEN1 (0.51) KCNH2MEN1KMT2AACKR3HTR2A
SCHEMBL31479775 0.90 MEN1 (0.51) KCNH2MEN1KMT2AACKR3HTR2A
SCHEMBL31479115 0.87 MEN1 (0.41) KCNH2MEN1KMT2AACKR3HTR2A
SCHEMBL31479281 0.87 MEN1 (0.41) KCNH2MEN1KMT2AACKR3HTR2A
SCHEMBL31478964 0.87 MEN1 (0.41) KCNH2MEN1KMT2AACKR3HTR2A
SCHEMBL31479857 0.83 KCNH2 (0.39) KCNH2MEN1KMT2AACKR3HTR2A
SCHEMBL31479165 0.81 SLC6A2 (0.35) KCNH2MEN1KMT2AHTR2AHTR7

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