SCHEMBL4018971

SCHEMBL4018971

O=C(O)c1cc(S(=O)(=O)N2CCc3c(ccnc3Nc3cnc4ccccc4c3)C2)ccc1F

nearest known ligand 0.76

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FAAH O00519 11/20 0.76
MAPT P10636 4/20 0.44
TP53 P04637 3/20 0.44
CYP3A4 P08684 1/20 0.42

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
SCHEMBL4014297 0.91 FAAH (0.76) FAAH
SCHEMBL4015887 0.91 FAAH (0.76) FAAHMAPT
SCHEMBL3930792 0.90 FAAH (0.80) FAAHMAPTTP53
SCHEMBL4017908 0.89 FAAH (0.72) FAAHMAPTCYP3A4
SCHEMBL3941337 0.88 FAAH (0.77) FAAHMAPTTP53
SCHEMBL4010751 0.88 FAAH (0.85) FAAH
SCHEMBL3942437 0.88 FAAH (0.88) FAAHMAPT
SCHEMBL3942978 0.87 FAAH (0.86) FAAH
SCHEMBL3941135 0.87 FAAH (1.00) FAAH
SCHEMBL4022356 0.87 FAAH (0.74) FAAHMAPTTP53

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-2009011904-A1 COMPOUNDS USEFUL AS FAAH MODULATORS AND USES THEREOF RENOVIS, INC. (US) 2009-01-22 WO disclosed