SCHEMBL3931338

SCHEMBL3931338

Cc1ccsc1S(=O)(=O)N1CCc2c(ccnc2Nc2cnc3ccccc3c2)C1

nearest known ligand 0.79

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FAAH O00519 11/20 0.79
ALDH1A1 P00352 2/20 0.39
LMNA P02545 1/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
HTR6 P50406 1/20 0.39
EPHX2 P34913 1/20 0.38
TNF P01375 1/20 0.37
GBA1 P04062 1/20 0.36
TRPV1 Q8NER1 1/20 0.36
KDM4E B2RXH2 1/20 0.35
ALPL P05186 1/20 0.35
MKNK1 Q9BUB5 1/20 0.35
HTR3A P46098 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
SCHEMBL3936952 0.87 FAAH (0.72) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3943336 0.87 FAAH (0.77) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3936894 0.86 FAAH (0.79) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3934237 0.85 FAAH (0.76) FAAHALDH1A1MAPK1MKNK1
SCHEMBL3940445 0.85 FAAH (0.84) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3941343 0.84 FAAH (0.86) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3941135 0.84 FAAH (1.00) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3938676 0.84 FAAH (0.75) FAAHALDH1A1EPHX2KDM4EALPL
SCHEMBL3934474 0.84 FAAH (0.75) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3931485 0.84 FAAH (0.73) 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