SCHEMBL19391175

SCHEMBL19391175

CCNc1cccc(C(=O)NCc2c(-c3ccccc3)[nH]n(C)c2=O)c1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.39
▸ MAPT P10636 1/20 0.39
▸ EZH2 Q15910 5/20 0.39
▸ ALOX5 P09917 1/20 0.38
▸ LIPG Q9Y5X9 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ MT-CO2 P00403 3/20 0.36
▸ ADRA1D P25100 1/20 0.36
▸ ADRA1A P35348 1/20 0.36
▸ ADRA1B P35368 1/20 0.36
▸ EED O75530 1/20 0.36
▸ RBBP4 Q09028 1/20 0.36
▸ SUZ12 Q15022 1/20 0.36
▸ AEBP2 Q6ZN18 1/20 0.36
▸ USP2 O75604 1/20 0.36
▸ CASP1 P29466 1/20 0.36
▸ BRCA1 P38398 1/20 0.36
▸ CASP7 P55210 1/20 0.36

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
SCHEMBL19390952 0.86 ALOX5 (0.41) KDM4EEZH2ALOX5ALDH1A1MEN1
SCHEMBL19390928 0.85 ALOX5 (0.40) KDM4EEZH2ALOX5MEN1KMT2A
SCHEMBL19391189 0.83 EZH2 (0.43) KDM4EEZH2ALOX5ALDH1A1MEN1
SCHEMBL19390670 0.80 EZH2 (0.42) EZH2ALOX5MEN1KMT2AMT-CO2
SCHEMBL19391004 0.78 EZH2 (0.41) EZH2ALOX5MEN1KMT2AMT-CO2
SCHEMBL19391186 0.77 EZH2 (0.45) KDM4EEZH2ALOX5ALDH1A1MEN1
SCHEMBL19391195 0.76 EZH2 (0.38) EZH2MEN1KMT2AMT-CO2ADRA1D
SCHEMBL19390662 0.75 EZH2 (0.40) KDM4EMAPTEZH2ALOX5ALDH1A1
SCHEMBL19391013 0.75 EZH2 (0.41) EZH2ALOX5MEN1KMT2AMT-CO2
SCHEMBL19390913 0.74 EZH2 (0.44) KDM4EEZH2ALOX5ALDH1A1MEN1

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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