SCHEMBL4012978

SCHEMBL4012978

N#Cc1ccc(S(=O)(=O)N2CCc3c(ccnc3Nc3cnc4ccccc4c3)C2)c(Cl)c1

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FAAH O00519 10/20 0.68
ALPL P05186 2/20 0.41
TRPV4 Q9HBA0 2/20 0.38
EPHX2 P34913 1/20 0.38
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
FABP1 P07148 1/20 0.36
CYP19A1 P11511 1/20 0.36
CNR2 P34972 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
SCHEMBL3934462 0.89 FAAH (0.72) FAAHALPLEPHX2ALDH1A1LMNA
SCHEMBL3939171 0.89 FAAH (0.77) FAAHALPLEPHX2ALDH1A1LMNA
SCHEMBL4017265 0.88 FAAH (0.82) FAAHALPLALDH1A1LMNAMAPK1
SCHEMBL3943262 0.88 FAAH (0.76) FAAHALPLEPHX2ALDH1A1LMNA
SCHEMBL3936957 0.87 FAAH (0.75) FAAHALPLEPHX2ALDH1A1LMNA
SCHEMBL4018424 0.87 FAAH (0.75) FAAHEPHX2ALDH1A1LMNAMAPK1
SCHEMBL4016363 0.86 FAAH (0.79) FAAHALPLALDH1A1LMNAMAPK1
SCHEMBL3931640 0.85 FAAH (0.73) FAAHALPLEPHX2ALDH1A1LMNA
SCHEMBL3930939 0.85 FAAH (0.73) FAAHALPLALDH1A1LMNAMAPK1
SCHEMBL3936249 0.84 FAAH (0.72) FAAHALPL

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