SCHEMBL12003045

SCHEMBL12003045

COC(=O)Oc1cccc(-c2cnc(C(=O)CCc3ccc(-c4ccc(CN5CCN(C)CC5)cc4)cc3)o2)n1

nearest known ligand 0.73

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.59
CES1 P23141 2/20 0.49

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
SCHEMBL12003072 0.94 FAAH (0.61) FAAHCES1
SCHEMBL12003071 0.93 FAAH (0.60) FAAHCES1
SCHEMBL12003127 0.92 FAAH (0.59) FAAHCES1
SCHEMBL12003074 0.92 FAAH (0.63) FAAHCES1
SCHEMBL12003108 0.91 FAAH (0.72) FAAHCES1
SCHEMBL12003251 0.87 FAAH (0.73) FAAHCES1
SCHEMBL2772475 0.87 FAAH (0.76) FAAHCES1
SCHEMBL15469738 0.86 FAAH (0.65) FAAHCES1
SCHEMBL2772850 0.84 FAAH (0.81) FAAHCES1
SCHEMBL12003207 0.84 FAAH (0.66) FAAHCES1

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-2152082-B1 TETRACYCLIC INHIBITORS OF FATTY ACID AMIDE HYDROLASE SCRIPPS RESEARCH INST (US) 2012-08-29 EP claimed