SCHEMBL15858006

SCHEMBL15858006

COc1ccc(CN2C(=O)c3ccc4c5cc(C#N)c6c7c(ccc(c8cc(C#N)c(c3c48)C2=O)c75)C(=O)N(Cc2ccc(OC)cc2)C6=O)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.51
▸ CASP3 P42574 2/20 0.46
▸ CLTC Q00610 1/20 0.43
▸ CMA1 P23946 1/20 0.43
▸ GSK3A P49840 1/20 0.41
▸ GSK3B P49841 1/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ CHRM5 P08912 2/20 0.41
▸ APAF1 O14727 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ SENP8 Q96LD8 1/20 0.41
▸ SENP7 Q9BQF6 1/20 0.41
▸ SENP6 Q9GZR1 1/20 0.41
▸ ALDH1A1 P00352 3/20 0.40
▸ MAPT P10636 2/20 0.40
▸ POLB P06746 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ ATM Q13315 1/20 0.40

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
SCHEMBL15858007 0.83 KDM4E (0.54) KDM4ECASP3CLTCCMA1GSK3A
SCHEMBL4651851 0.82 KDM4E (0.68) KDM4ECASP3CLTCCMA1GSK3A
SCHEMBL30530601 0.82 KDM4E (0.68) KDM4ECASP3CLTCCMA1GSK3A
SCHEMBL29392718 0.82 KDM4E (0.68) KDM4ECASP3CLTCCMA1GSK3A
SCHEMBL15858011 0.80 KDM4E (0.50) KDM4ECASP3CLTCCMA1GSK3A
SCHEMBL24414744 0.78 KDM4E (0.61) KDM4ECASP3CLTCCMA1GSK3A
SCHEMBL25063276 0.77 KDM4E (0.57) KDM4ECASP3CLTCCMA1GSK3A
SCHEMBL15773124 0.77 KDM4E (0.75) KDM4ECASP3CLTCCMA1GSK3A
SCHEMBL8680697 0.70 KDM4E (0.63) KDM4ECASP3CMA1MEN1KMT2A
SCHEMBL4653005 0.70 KDM4E (0.50) KDM4ECASP3MEN1KMT2AALDH1A1

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-2014100961-A1 USE OF COMPOUNDS OF THE PERYLENE TYPE AS ACCEPTORS IN PHOTOVOLTAICS RHODIA OPERATIONS (FR) 2014-07-03 — — WO disclosed
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