SCHEMBL3934474

SCHEMBL3934474

Cc1ccc(C)c(S(=O)(=O)N2CCc3c(ccnc3Nc3cnc4ccccc4c3)C2)c1

nearest known ligand 0.75

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FAAH O00519 10/20 0.75
EPHX2 P34913 2/20 0.47
HCRTR1 O43613 2/20 0.46
HCRTR2 O43614 2/20 0.46
ALDH1A1 P00352 3/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ALPL P05186 3/20 0.42
TP53 P04637 1/20 0.40
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39

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
SCHEMBL3938676 0.93 FAAH (0.75) FAAHEPHX2ALDH1A1ALPLKDM4E
SCHEMBL3931245 0.92 FAAH (0.74) FAAHEPHX2HCRTR1HCRTR2ALDH1A1
SCHEMBL3936894 0.92 FAAH (0.79) FAAHEPHX2HCRTR1HCRTR2ALDH1A1
SCHEMBL3931635 0.90 FAAH (0.71) FAAHEPHX2RAB9ASMN1; SMN2ALPL
SCHEMBL3934207 0.90 FAAH (0.73) FAAHEPHX2ALPL
SCHEMBL3945042 0.89 FAAH (0.69) FAAHEPHX2L3MBTL1ALPLLMNA
SCHEMBL3941343 0.89 FAAH (0.86) FAAHEPHX2ALDH1A1SMN1; SMN2ALPL
SCHEMBL3935918 0.88 FAAH (0.76) FAAHEPHX2ALDH1A1RAB9ASMN1; SMN2
SCHEMBL3940445 0.88 FAAH (0.84) FAAHEPHX2ALDH1A1RAB9ASMN1; SMN2
SCHEMBL3930696 0.88 FAAH (0.72) FAAHEPHX2ALDH1A1RAB9ASMN1; SMN2

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