SCHEMBL3931347

SCHEMBL3931347

O=S(=O)(Cc1cccc(C(F)(F)F)c1)N1CCc2c(ccnc2Nc2cnc3ccccc3c2)C1

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FAAH O00519 11/20 0.69
GPR142 Q7Z601 1/20 0.43
TRPV1 Q8NER1 2/20 0.40
KDR P35968 1/20 0.37
ALPL P05186 1/20 0.37
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
ULK1 O75385 1/20 0.36
CNR1 P21554 1/20 0.36
CNR2 P34972 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
SCHEMBL3940702 0.94 FAAH (0.70) FAAHGPR142TRPV1ALPLALDH1A1
SCHEMBL3939496 0.89 FAAH (0.78) FAAHTRPV1ALDH1A1LMNAMAPK1
SCHEMBL3934937 0.88 FAAH (0.77) FAAHALPLALDH1A1LMNAMAPK1
SCHEMBL3933874 0.87 FAAH (0.75) FAAHTRPV1ALDH1A1LMNAMAPK1
SCHEMBL3932159 0.86 FAAH (0.79) FAAHTRPV1HTTCNR1
SCHEMBL3933574 0.86 FAAH (0.70) FAAHTRPV1KDRALDH1A1LMNA
SCHEMBL3930967 0.85 FAAH (0.72) FAAHTRPV1ALPLALDH1A1LMNA
SCHEMBL3933728 0.85 FAAH (0.79) FAAHTRPV1ALPLALDH1A1LMNA
SCHEMBL3931969 0.85 FAAH (0.79) FAAHALPLALDH1A1LMNAMAPK1
SCHEMBL3935806 0.84 FAAH (0.78) FAAHTRPV1ALPLALDH1A1LMNA

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