SCHEMBL4020206

SCHEMBL4020206

Cc1nn(C)cc1S(=O)(=O)N1CCc2c(ccnc2Nc2cnc3ccccc3c2)C1

nearest known ligand 0.73

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FAAH O00519 10/20 0.73
ALDH1A1 P00352 3/20 0.40
LMNA P02545 1/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
POLB P06746 1/20 0.40
EPHX2 P34913 1/20 0.39
TNF P01375 1/20 0.38
GAA P10253 1/20 0.37
CHRM5 P08912 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
SCHEMBL4013257 0.90 FAAH (0.68) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3936894 0.87 FAAH (0.79) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL4017126 0.86 FAAH (0.72) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3931443 0.85 FAAH (0.77) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL4017621 0.85 FAAH (0.71) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3931640 0.85 FAAH (0.73) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3938676 0.85 FAAH (0.75) FAAHALDH1A1EPHX2GAA
SCHEMBL3934474 0.85 FAAH (0.75) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL4008248 0.85 FAAH (0.73) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3940445 0.85 FAAH (0.84) 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