SCHEMBL4007889

SCHEMBL4007889

COC(=O)c1cc(C)c(S(=O)(=O)N2CCc3c(ccnc3Nc3cnc4ccccc4c3)C2)s1

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FAAH O00519 11/20 0.67
EPHX2 P34913 1/20 0.40
ALPL P05186 3/20 0.37
ALDH1A1 P00352 2/20 0.35
TNF P01375 1/20 0.35
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35
HTT P42858 1/20 0.35
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
RAB9A P51151 1/20 0.35
HSD17B10 Q99714 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
TRPV1 Q8NER1 1/20 0.35
NOTUM Q6P988 1/20 0.34

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
SCHEMBL4014998 0.85 FAAH (0.70) FAAHEPHX2ALPLALDH1A1KDM4E
SCHEMBL4012470 0.84 FAAH (0.78) FAAHEPHX2ALPLALDH1A1LMNA
SCHEMBL3931338 0.84 FAAH (0.79) FAAHEPHX2ALPLALDH1A1TNF
SCHEMBL3936952 0.84 FAAH (0.72) FAAHEPHX2ALPLALDH1A1TNF
SCHEMBL3936894 0.83 FAAH (0.79) FAAHEPHX2ALPLALDH1A1TNF
SCHEMBL4011830 0.82 FAAH (0.65) FAAHEPHX2ALPLALDH1A1TNF
SCHEMBL4019611 0.82 FAAH (0.65) FAAHEPHX2ALPLALDH1A1TNF
SCHEMBL3932569 0.82 FAAH (0.79) FAAHEPHX2ALDH1A1TNFLMNA
SCHEMBL4016142 0.82 FAAH (0.67) FAAHEPHX2ALPLALDH1A1LMNA
SCHEMBL3929062 0.82 FAAH (0.75) FAAHALPLLMNA

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 2 patents. 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
WO-2009011904-A1 COMPOUNDS USEFUL AS FAAH MODULATORS AND USES THEREOF RENOVIS, INC. (US) 2009-01-22 WO disclosed