SCHEMBL13880939

SCHEMBL13880939

CCN1CC(NC(=O)c2cc(OC)c(N)cc2F)C1

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.53
MEN1 O00255 1/20 0.53
MAPT P10636 1/20 0.53
KMT2A Q03164 1/20 0.53
HTR4 Q13639 1/20 0.52

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
SCHEMBL3539061 0.89 KDM4E (0.69) KDM4EMEN1MAPTKMT2AHTR4
SCHEMBL13880862 0.84 ALDH1A1 (0.48) KDM4EMEN1MAPTKMT2AHTR4
SCHEMBL13881173 0.84 HRH3 (0.44) KDM4EMEN1MAPTKMT2AHTR4
SCHEMBL13461317 0.82 HTR4 (0.52) KDM4EMEN1MAPTKMT2AHTR4
SCHEMBL13457545 0.82 KDM4E (0.47) KDM4EMEN1MAPTKMT2AHTR4
SCHEMBL13881180 0.81 HTR4 (0.51) KDM4EMEN1MAPTKMT2AHTR4
SCHEMBL3942580 0.81 HTR4 (0.47) KDM4EMEN1MAPTKMT2AHTR4
SCHEMBL3538922 0.81 HTR4 (0.47) KDM4EMEN1MAPTKMT2AHTR4
SCHEMBL13880913 0.80 HTR4 (0.68) KDM4EMEN1MAPTKMT2AHTR4
SCHEMBL1163804 0.80 KDM4E (0.51) KDM4EMEN1MAPTKMT2AHTR4

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-2009042711-A1 POLO-LIKE KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-04-02 WO disclosed