SCHEMBL3942824

SCHEMBL3942824

O=S(=O)(c1cccc(Cl)c1F)N1CCc2c(ccnc2Nc2cnc3ccccc3c2)C1

nearest known ligand 0.71

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FAAH O00519 11/20 0.71
EPHX2 P34913 1/20 0.39
ALPL P05186 2/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
MKNK1 Q9BUB5 2/20 0.38
HTR6 P50406 1/20 0.37
CNR2 P34972 1/20 0.37
GRM4 Q14833 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
SCHEMBL3939171 0.92 FAAH (0.77) FAAHEPHX2ALPLALDH1A1LMNA
SCHEMBL3933625 0.90 FAAH (0.73) FAAHEPHX2ALPLALDH1A1LMNA
SCHEMBL3934462 0.89 FAAH (0.72) FAAHEPHX2ALPLALDH1A1LMNA
SCHEMBL3942409 0.89 FAAH (0.77) FAAHALPLALDH1A1LMNAMAPK1
SCHEMBL3933957 0.89 FAAH (0.77) FAAHEPHX2ALPLALDH1A1LMNA
SCHEMBL3935789 0.88 FAAH (0.73) FAAHEPHX2ALPLALDH1A1LMNA
SCHEMBL3943262 0.88 FAAH (0.76) FAAHEPHX2ALPLALDH1A1LMNA
SCHEMBL3936249 0.88 FAAH (0.72) FAAHALPLMKNK1
SCHEMBL3934225 0.88 FAAH (0.72) FAAHALPLALDH1A1LMNAMAPK1
SCHEMBL3934482 0.87 FAAH (0.75) FAAHEPHX2ALPLALDH1A1LMNA

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