SCHEMBL18830197

SCHEMBL18830197

COC(=O)c1cc(C)cc(N(C)CC2CCOCC2)c1C

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 8/20 0.43
CNR2 P34972 5/20 0.36
CNR1 P21554 4/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
GAA P10253 1/20 0.35
KMT2A Q03164 1/20 0.35
PTGER4 P35408 1/20 0.34
OPRK1 P41145 1/20 0.33
RORC P51449 1/20 0.33
CRHR1 P34998 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
SCHEMBL15710286 0.88 EZH2 (0.42) CSF1RCNR2CNR1
SCHEMBL15731239 0.81 EZH2 (0.44) NPC1RAB9AKMT2AOPRK1
SCHEMBL22495103 0.79 EZH2 (0.49)
SCHEMBL15710346 0.77 ALDH1A1 (0.38) CNR1KMT2APTGER4OPRK1
SCHEMBL15710364 0.76 EZH2 (0.45) CSF1RCRHR1
SCHEMBL18830443 0.76 PTGER4 (0.51) CNR2CNR1NPC1RAB9AKMT2A
SCHEMBL13279921 0.75 EZH2 (0.39) CSF1RNPC1RAB9AGAAKMT2A
SCHEMBL18829947 0.73 CYP46A1 (0.34) CNR2GAAKMT2A
SCHEMBL13277336 0.73 EZH2 (0.49) OPRK1CRHR1
SCHEMBL18829944 0.72 EZH2 (0.41) NPC1GAAOPRK1

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