SCHEMBL3476128

SCHEMBL3476128

Cn1ccc2cc(-c3ccc4oc(-c5cc[c]cc5)nc4c3)ccc21

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FAAH O00519 17/20 0.58
APP P05067 2/20 0.51
KDM4E B2RXH2 1/20 0.45
NPC1 O15118 1/20 0.45
ALDH1A1 P00352 1/20 0.45
TP53 P04637 1/20 0.45
HPGD P15428 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HSD17B10 Q99714 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
SCHEMBL3477643 0.80 FAAH (0.57) FAAHAPP
SCHEMBL3141145 0.80 PRKCI (0.50) FAAHAPP
SCHEMBL3477481 0.78 APP (0.60) FAAHAPPKDM4ENPC1ALDH1A1
SCHEMBL3476971 0.78 FAAH (0.64) FAAHAPP
SCHEMBL713750 0.78 ALDH1A1 (0.69) KDM4ENPC1ALDH1A1TP53HPGD
SCHEMBL712315 0.76 SMN1; SMN2 (0.59) KDM4ENPC1ALDH1A1TP53HPGD
SCHEMBL3478456 0.76 FAAH (0.72) FAAH
SCHEMBL3478154 0.76 FAAH (0.53) FAAHAPP
SCHEMBL3476620 0.73 FAAH (1.00) FAAH
SCHEMBL3476334 0.73 FAAH (0.95) FAAH

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