SCHEMBL19391017

SCHEMBL19391017

CCNc1cccc(C(=O)NCc2c(C)[nH]n(CC(F)(F)F)c2=O)c1C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EZH2 Q15910 7/20 0.37
▸ EED O75530 1/20 0.36
▸ RBBP4 Q09028 1/20 0.36
▸ SUZ12 Q15022 1/20 0.36
▸ AEBP2 Q6ZN18 1/20 0.36
▸ BCHE P06276 1/20 0.35
▸ MT-CO2 P00403 5/20 0.34
▸ ADRA1D P25100 1/20 0.34
▸ ADRA1A P35348 1/20 0.34
▸ ADRA1B P35368 1/20 0.34
▸ PDE10A Q9Y233 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ ALOX5 P09917 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ USP2 O75604 1/20 0.33
▸ CASP1 P29466 1/20 0.33
▸ BRCA1 P38398 1/20 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
SCHEMBL19390662 0.84 EZH2 (0.40) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL19391133 0.83 EZH2 (0.36) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL19390952 0.83 ALOX5 (0.41) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL19391013 0.76 EZH2 (0.41) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL19390913 0.76 EZH2 (0.44) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL19390928 0.76 ALOX5 (0.40) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL19390670 0.75 EZH2 (0.42) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL19391189 0.74 EZH2 (0.43) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL19391135 0.74 EZH2 (0.43) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL18744313 0.74 CYP1A2 (0.33) —

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
EP-3022184-B1 SUBSTITUTED BENZENE COMPOUNDS EPIZYME INC (US) 2017-09-27 — — EP disclosed
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