SCHEMBL4748396

SCHEMBL4748396

COC(=O)c1cccc(OC(=O)NC2CCCC2)c1

nearest known ligand 0.69

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.62
TRPA1 O75762 1/20 0.62
EPHX2 P34913 1/20 0.62
FAAH2 Q6GMR7 1/20 0.62
MGLL Q99685 1/20 0.62
HDAC6 Q9UBN7 1/20 0.62
ALDH1A1 P00352 1/20 0.61
RAB9A P51151 1/20 0.61
EPHX1 P07099 1/20 0.58

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
SCHEMBL4751725 0.99 FAAH (0.65) FAAHTRPA1EPHX2FAAH2MGLL
SCHEMBL4965649 0.86 FAAH (0.66) FAAHTRPA1EPHX2FAAH2MGLL
SCHEMBL4183181 0.85 FAAH (0.71) FAAHTRPA1EPHX2FAAH2MGLL
SCHEMBL4750537 0.84 FAAH (0.86) FAAHTRPA1EPHX2FAAH2MGLL
SCHEMBL14470485 0.83 FAAH (0.62) FAAHTRPA1EPHX2FAAH2MGLL
SCHEMBL31418120 0.81 FAAH (0.63) FAAHTRPA1EPHX2FAAH2MGLL
SCHEMBL31418131 0.81 FAAH (0.65) FAAHTRPA1EPHX2FAAH2MGLL
SCHEMBL14044821 0.80 FAAH (0.67) FAAHTRPA1EPHX2FAAH2MGLL
SCHEMBL26407281 0.79 RAB9A (0.69) EPHX2ALDH1A1RAB9A
SCHEMBL14288607 0.79 FAAH (0.62) FAAHTRPA1EPHX2FAAH2MGLL

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-2008129129-A1 HETEROCYCLIC PHENYL CARBAMATES AS NOVEL FAAH-INHIBITORS KUOPION YLIOPISTO (FI) 2008-10-30 WO disclosed