SCHEMBL3932569

SCHEMBL3932569

Cc1cc(S(=O)(=O)N2CCc3c(ccnc3Nc3cnc4ccccc4c3)C2)c(C)s1

nearest known ligand 0.79

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FAAH O00519 10/20 0.79
LMNA P02545 2/20 0.40
GAA P10253 1/20 0.40
EPHX2 P34913 1/20 0.40
ALDH1A1 P00352 3/20 0.39
TSHR P16473 3/20 0.39
MAPT P10636 2/20 0.39
GFER P55789 1/20 0.39
MAPK1 P28482 2/20 0.39
HTT P42858 2/20 0.39
MKNK1 Q9BUB5 1/20 0.37
TNF P01375 1/20 0.37
TRPV1 Q8NER1 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
SCHEMBL3936894 0.88 FAAH (0.79) FAAHLMNAEPHX2ALDH1A1MAPK1
SCHEMBL3931485 0.87 FAAH (0.73) FAAHLMNAEPHX2ALDH1A1TSHR
SCHEMBL3931443 0.86 FAAH (0.77) FAAHLMNAEPHX2ALDH1A1MAPK1
SCHEMBL3938676 0.86 FAAH (0.75) FAAHGAAEPHX2ALDH1A1
SCHEMBL3934474 0.86 FAAH (0.75) FAAHLMNAEPHX2ALDH1A1MAPK1
SCHEMBL3940445 0.85 FAAH (0.84) FAAHLMNAGAAEPHX2ALDH1A1
SCHEMBL3936952 0.85 FAAH (0.72) FAAHLMNAEPHX2ALDH1A1MAPK1
SCHEMBL3941351 0.85 FAAH (0.74) FAAHLMNAEPHX2ALDH1A1MAPK1
SCHEMBL3931250 0.85 FAAH (0.74) FAAHLMNAGAAEPHX2ALDH1A1
SCHEMBL3931245 0.85 FAAH (0.74) FAAHLMNAEPHX2ALDH1A1MAPT

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