SCHEMBL3933101

SCHEMBL3933101

COc1ccc(Oc2cccc(S(=O)(=O)N3CCc4c(ccnc4Nc4cnc5ccccc5c4)C3)c2)cc1

nearest known ligand 0.73

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FAAH O00519 10/20 0.73
ALPL P05186 1/20 0.47
MKNK1 Q9BUB5 4/20 0.45
IGF1R P08069 2/20 0.42
AKR1C3 P42330 3/20 0.40

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
SCHEMBL3932545 0.95 FAAH (0.79) FAAHALPLMKNK1IGF1RAKR1C3
SCHEMBL3942417 0.94 FAAH (0.78) FAAHALPLMKNK1IGF1R
SCHEMBL3941303 0.91 FAAH (0.82) FAAHALPLMKNK1IGF1R
SCHEMBL3944150 0.90 FAAH (0.70) FAAHALPLIGF1R
SCHEMBL3934738 0.90 FAAH (0.72) FAAHALPLMKNK1AKR1C3
SCHEMBL3931396 0.90 FAAH (0.85) FAAHMKNK1
SCHEMBL3943232 0.89 FAAH (0.78) FAAHMKNK1IGF1R
SCHEMBL3939941 0.86 FAAH (0.76) FAAHALPLMKNK1IGF1RAKR1C3
SCHEMBL3932908 0.86 FAAH (0.83) FAAHALPLMKNK1AKR1C3
SCHEMBL3937394 0.85 FAAH (0.75) FAAHMKNK1

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