SCHEMBL18830366

SCHEMBL18830366

CC(=O)c1cc(C(F)(F)F)cc(N(C)C2CCCC2)c1C

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EZH2 Q15910 8/20 0.39
RAB9A P51151 2/20 0.38
POLB P06746 1/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
LMNA P02545 1/20 0.34
GPR35 Q9HC97 3/20 0.34
EPHX1 P07099 1/20 0.34
PDE3B Q13370 1/20 0.33
PDE3A Q14432 1/20 0.33
GAA P10253 1/20 0.33
MCHR1 Q99705 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
SCHEMBL13280323 0.89 RXRA (0.39) EZH2RAB9APOLBALDH1A1MAPT
SCHEMBL15709875 0.86 CFTR (0.40) EZH2RAB9APOLBALDH1A1GPR35
SCHEMBL18830367 0.83 EZH2 (0.40) EZH2ALDH1A1MAPTNPSR1LMNA
SCHEMBL18829848 0.81 EZH2 (0.54) EZH2ALDH1A1MAPTNPSR1LMNA
SCHEMBL18829845 0.80 ALDH1A1 (0.41) EZH2RAB9AALDH1A1MAPTNPSR1
SCHEMBL13468049 0.79 EZH2 (0.39) EZH2RAB9AALDH1A1MAPTNPSR1
SCHEMBL18829979 0.74 LMNA (0.47) EZH2ALDH1A1MAPTNPSR1LMNA
SCHEMBL18830419 0.74 EZH2 (0.36) EZH2RAB9AALDH1A1MAPTNPSR1
SCHEMBL13280553 0.69 EZH2 (0.54) EZH2ALDH1A1MAPTNPSR1GAA
SCHEMBL18830127 0.69 EZH2 (0.49) EZH2RAB9APOLBALDH1A1MAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3470396-A1 SUBSTITUTED BENZENE COMPOUNDS Epizyme, Inc. (US) 2019-04-17 EP disclosed
EP-3165520-A1 SUBSTITUTED BENZENE COMPOUNDS Epizyme Inc (US) 2017-05-10 EP disclosed