SCHEMBL3930696

SCHEMBL3930696

Cc1ccc(-c2ccccc2S(=O)(=O)N2CCc3c(ccnc3Nc3cnc4ccccc4c3)C2)cc1

nearest known ligand 0.72

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FAAH O00519 10/20 0.72
EPHX2 P34913 1/20 0.42
FABP1 P07148 4/20 0.40
ALDH1A1 P00352 2/20 0.40
ALPL P05186 2/20 0.40
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
TP53 P04637 1/20 0.37
NPC1 O15118 1/20 0.37
POLB P06746 1/20 0.37
MAPT P10636 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL3941391 0.93 FAAH (0.77) FAAHEPHX2FABP1ALDH1A1LMNA
SCHEMBL3932778 0.92 FAAH (0.70) FAAHFABP1ALDH1A1ALPLLMNA
SCHEMBL3933996 0.91 FAAH (0.67) FAAHFABP1ALPLLMNATP53
SCHEMBL3936894 0.88 FAAH (0.79) FAAHEPHX2ALDH1A1ALPLKDM4E
SCHEMBL3941343 0.88 FAAH (0.86) FAAHEPHX2ALDH1A1ALPLKDM4E
SCHEMBL3934474 0.88 FAAH (0.75) FAAHEPHX2ALDH1A1ALPLKDM4E
SCHEMBL3938676 0.88 FAAH (0.75) FAAHEPHX2ALDH1A1ALPLKDM4E
SCHEMBL3932554 0.87 FAAH (0.70) FAAHEPHX2ALDH1A1ALPLKDM4E
SCHEMBL3931443 0.87 FAAH (0.77) FAAHEPHX2ALDH1A1ALPLKDM4E
SCHEMBL3934207 0.86 FAAH (0.73) FAAHEPHX2ALPL

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