SCHEMBL3935918

SCHEMBL3935918

Cc1ccnc(S(=O)(=O)N2CCc3c(ccnc3Nc3cnc4ccccc4c3)C2)c1

nearest known ligand 0.76

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FAAH O00519 11/20 0.76
EPHX2 P34913 1/20 0.41
ALDH1A1 P00352 2/20 0.40
LMNA P02545 1/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
ALPL P05186 3/20 0.39
KDM4E B2RXH2 1/20 0.39
TNF P01375 1/20 0.38
TRPV1 Q8NER1 1/20 0.37
MKNK1 Q9BUB5 1/20 0.36
NPC1 O15118 1/20 0.35
POLB P06746 1/20 0.35
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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 0.90 FAAH (0.80) FAAHEPHX2ALDH1A1LMNAMAPK1
SCHEMBL3940445 0.89 FAAH (0.84) FAAHEPHX2ALDH1A1LMNAMAPK1
SCHEMBL3932908 0.89 FAAH (0.83) FAAHEPHX2ALDH1A1LMNAMAPK1
SCHEMBL3941343 0.89 FAAH (0.86) FAAHEPHX2ALDH1A1LMNAMAPK1
SCHEMBL3934207 0.88 FAAH (0.73) FAAHEPHX2ALPLMKNK1
SCHEMBL3938676 0.88 FAAH (0.75) FAAHEPHX2ALDH1A1ALPLKDM4E
SCHEMBL3934474 0.88 FAAH (0.75) FAAHEPHX2ALDH1A1LMNAMAPK1
SCHEMBL4017126 0.87 FAAH (0.72) FAAHEPHX2ALDH1A1LMNAMAPK1
SCHEMBL3936894 0.87 FAAH (0.79) FAAHEPHX2ALDH1A1LMNAMAPK1
SCHEMBL3941135 0.86 FAAH (1.00) 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