SCHEMBL3476716

SCHEMBL3476716

COC(=O)Nc1ccc(-c2ccc3oc(NC4CCCCC4)nc3c2)cc1

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FAAH O00519 8/20 0.63
HDAC6 Q9UBN7 2/20 0.56
AGPAT2 O15120 4/20 0.52
PIK3CA P42336 2/20 0.48
SSTR5 P35346 2/20 0.45
SSTR1 P30872 1/20 0.45
HRH1 P35367 1/20 0.45

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
SCHEMBL3477409 0.81 FAAH (0.71) FAAHHDAC6PIK3CA
SCHEMBL3474873 0.81 FAAH (0.60) FAAHHDAC6PIK3CA
SCHEMBL3477717 0.81 HDAC6 (0.67) FAAHHDAC6PIK3CASSTR5
SCHEMBL3477307 0.80 FAAH (0.66) FAAHHDAC6PIK3CA
SCHEMBL3476787 0.79 FAAH (0.72) FAAHHDAC6PIK3CASSTR5
SCHEMBL3475828 0.79 FAAH (0.66) FAAHHDAC6PIK3CASSTR5
SCHEMBL3475819 0.79 FAAH (0.65) FAAHHDAC6PIK3CA
SCHEMBL3475812 0.78 FAAH (0.62) FAAHHDAC6PIK3CA
SCHEMBL3475830 0.78 FAAH (0.64) FAAHHDAC6PIK3CASSTR5SSTR1
SCHEMBL13436763 0.78 FAAH (0.76) FAAHHDAC6PIK3CASSTR5

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
WO-2010039186-A2 COMPOUNDS USEFUL AS FAAH MODULATORS AND USES THEREOF RENOVIS, INC. (US) 2010-04-08 WO disclosed
WO-2010039186-A2 COMPOUNDS USEFUL AS FAAH MODULATORS AND USES THEREOF RENOVIS, INC. (US) 2010-04-08 WO disclosed