SCHEMBL3477307

SCHEMBL3477307

c1ccc(-c2ccc3oc(NC4CCCCC4)nc3c2)cc1

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FAAH O00519 8/20 0.66
PIK3CA P42336 2/20 0.60
HDAC6 Q9UBN7 1/20 0.58
ELANE P08246 1/20 0.55
GAA P10253 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
MAPT P10636 1/20 0.47
MAOB P27338 1/20 0.46
DGAT1 O75907 1/20 0.46
PDE5A O76074 1/20 0.44
ACP1 P24666 1/20 0.44
ADORA2A P29274 1/20 0.44
ADORA1 P30542 1/20 0.44

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 0.88 FAAH (0.71) FAAHPIK3CAHDAC6ELANEGAA
SCHEMBL3475819 0.88 FAAH (0.65) FAAHPIK3CAHDAC6ELANE
SCHEMBL13436763 0.85 FAAH (0.76) FAAHPIK3CAHDAC6ELANEMAPT
SCHEMBL3477428 0.85 FAAH (0.64) FAAHPIK3CAHDAC6ELANE
SCHEMBL3475989 0.85 FAAH (0.60) FAAHPIK3CAHDAC6ELANE
SCHEMBL3477061 0.85 FAAH (0.58) FAAHPIK3CAHDAC6ELANEMAPT
SCHEMBL3475774 0.84 FAAH (0.61) FAAHPIK3CAHDAC6ELANEMAPT
SCHEMBL3474618 0.84 FAAH (0.62) FAAHPIK3CAHDAC6ELANE
SCHEMBL3475416 0.83 FAAH (0.61) FAAHPIK3CAHDAC6ELANE
SCHEMBL3477717 0.83 HDAC6 (0.67) FAAHPIK3CAHDAC6ELANEDGAT1

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