SCHEMBL3932389

SCHEMBL3932389

O=S(=O)(c1cc(Cl)c(Cl)s1)N1CCc2c(ccnc2Nc2cnc3ccccc3c2)C1

nearest known ligand 0.72

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FAAH O00519 11/20 0.72
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
MKNK1 Q9BUB5 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ALPL P05186 2/20 0.36
EPHX2 P34913 1/20 0.34
TRPV1 Q8NER1 1/20 0.34
IGF1R P08069 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
SCHEMBL3933627 0.89 FAAH (0.73) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3931080 0.88 FAAH (0.75) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3934554 0.87 FAAH (0.72) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3939171 0.86 FAAH (0.77) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3933957 0.86 FAAH (0.77) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3931485 0.86 FAAH (0.73) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3937438 0.86 FAAH (0.73) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3934237 0.85 FAAH (0.76) FAAHALDH1A1MAPK1MKNK1
SCHEMBL3943262 0.85 FAAH (0.76) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3936957 0.85 FAAH (0.75) 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