SCHEMBL4008248

SCHEMBL4008248

Cn1ccc(S(=O)(=O)N2CCc3c(ccnc3Nc3cnc4ccccc4c3)C2)n1

nearest known ligand 0.73

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FAAH O00519 11/20 0.73
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
TRPV1 Q8NER1 1/20 0.36
TNF P01375 1/20 0.35
EPHX2 P34913 1/20 0.35
FGFR4 P22455 1/20 0.35
HTR6 P50406 2/20 0.35
HTR7 P34969 1/20 0.35
HTR3A P46098 1/20 0.34
GRM4 Q14833 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
SCHEMBL3936835 0.87 FAAH (0.80) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL4012396 0.86 FAAH (0.73) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3935918 0.86 FAAH (0.76) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL4017126 0.86 FAAH (0.72) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL4020206 0.85 FAAH (0.73) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3941135 0.85 FAAH (1.00) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3940445 0.84 FAAH (0.84) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3935806 0.84 FAAH (0.78) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3942954 0.84 FAAH (0.75) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3932629 0.84 FAAH (0.75) 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