SCHEMBL3930671

SCHEMBL3930671

O=S(=O)(Cc1ccc(F)cc1F)N1CCc2c(ccnc2Nc2cnc3ccccc3c2)C1

nearest known ligand 0.77

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FAAH O00519 12/20 0.77
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
GRM4 Q14833 1/20 0.37
TRPV1 Q8NER1 1/20 0.36
MKNK1 Q9BUB5 1/20 0.35
ALPL P05186 1/20 0.35
IGF1R P08069 1/20 0.35
GPR6 P46095 1/20 0.34
HTR7 P34969 1/20 0.34
HTR6 P50406 1/20 0.34

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
SCHEMBL3933874 0.89 FAAH (0.75) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3933565 0.87 FAAH (1.00) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3939496 0.86 FAAH (0.78) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3935806 0.86 FAAH (0.78) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3932111 0.86 FAAH (0.75) FAAHMKNK1
SCHEMBL3932857 0.84 FAAH (0.68) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3943803 0.84 FAAH (0.77) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3930967 0.84 FAAH (0.72) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3933728 0.83 FAAH (0.79) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3931969 0.83 FAAH (0.79) FAAHALDH1A1LMNAMAPK1HTT

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