SCHEMBL3944150

SCHEMBL3944150

O=S(=O)(c1cccc(Oc2ccc(C(F)(F)F)cc2)c1)N1CCc2c(ccnc2Nc2cnc3ccccc3c2)C1

nearest known ligand 0.70

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FAAH O00519 11/20 0.70
SCN9A Q15858 1/20 0.38
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
ALPL P05186 2/20 0.38
TRPV1 Q8NER1 2/20 0.37
HSD11B1 P28845 1/20 0.36
IGF1R P08069 1/20 0.36

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
SCHEMBL3935259 0.94 FAAH (0.75) FAAHSCN9ACNR1CNR2ALPL
SCHEMBL3933101 0.90 FAAH (0.73) FAAHALPLIGF1R
SCHEMBL3932159 0.89 FAAH (0.79) FAAHCNR1TRPV1HSD11B1
SCHEMBL3943266 0.89 FAAH (0.82) FAAHCNR1CNR2ALPLTRPV1
SCHEMBL3934738 0.88 FAAH (0.72) FAAHALPL
SCHEMBL3931396 0.88 FAAH (0.85) FAAH
SCHEMBL3932545 0.86 FAAH (0.79) FAAHALPLIGF1R
SCHEMBL3939941 0.86 FAAH (0.76) FAAHALPLIGF1R
SCHEMBL3942417 0.84 FAAH (0.78) FAAHALPLIGF1R
SCHEMBL3934243 0.84 FAAH (0.83) 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-2009011904-A1 COMPOUNDS USEFUL AS FAAH MODULATORS AND USES THEREOF RENOVIS, INC. (US) 2009-01-22 WO disclosed