SCHEMBL4019347

SCHEMBL4019347

CNCCNc1c(Cl)cccc1C(=O)[C@H]1CN(CCNC)C[C@H](C(=O)c2cccc(O)c2)[C@@H]1c1cccc(F)c1C

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
MAPK1 P28482 1/20 0.33
MGLL Q99685 1/20 0.31
CARM1 Q86X55 2/20 0.30
PRMT6 Q96LA8 2/20 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
SCHEMBL4029451 0.89 CARM1 (0.37) MEN1KMT2AMGLLCARM1PRMT6
SCHEMBL4024826 0.88 GAA (0.36) MEN1KMT2AMAPK1MGLLCARM1
SCHEMBL4022484 0.86 CARM1 (0.32) MEN1KMT2ACARM1PRMT6
SCHEMBL4029054 0.86 KDM2B (0.33) CARM1PRMT6
SCHEMBL4020351 0.84 ESR1 (0.34) CARM1PRMT6
SCHEMBL4024736 0.83 DRD3 (0.34) MEN1KMT2ACARM1PRMT6
SCHEMBL4021552 0.83 DRD3 (0.36) MEN1KMT2A
SCHEMBL4022598 0.82 MEN1 (0.35) MEN1KMT2AMAPK1MGLL
SCHEMBL4027102 0.81 MEN1 (0.31) MEN1KMT2A
SCHEMBL4022270 0.81 KDM2B (0.39) MEN1KMT2A

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
US-7572814-B2 3,5-dibenzoyl-4-phenyl-piperidine anti-cancer compounds CYTOKINETICS, INCORPORATED (US) 2009-08-11 US claimed