SCHEMBL3933625

SCHEMBL3933625

Cc1c(Cl)cccc1S(=O)(=O)N1CCc2c(ccnc2Nc2cnc3ccccc3c2)C1

nearest known ligand 0.73

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FAAH O00519 11/20 0.73
EPHX2 P34913 1/20 0.42
LMNA P02545 2/20 0.38
ALDH1A1 P00352 2/20 0.38
TNF P01375 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
HTR6 P50406 1/20 0.37
ALPL P05186 1/20 0.37
KDM4E B2RXH2 1/20 0.36
USP2 O75604 1/20 0.36
MAPT P10636 1/20 0.36
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ESR1 P03372 2/20 0.36
ESR2 Q92731 2/20 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
SCHEMBL3939171 0.92 FAAH (0.77) FAAHEPHX2LMNAALDH1A1MAPK1
SCHEMBL3942824 0.90 FAAH (0.71) FAAHEPHX2LMNAALDH1A1MAPK1
SCHEMBL3943195 0.90 FAAH (0.70) FAAHEPHX2LMNAALDH1A1TNF
SCHEMBL3936894 0.89 FAAH (0.79) FAAHEPHX2LMNAALDH1A1TNF
SCHEMBL3933957 0.89 FAAH (0.77) FAAHEPHX2LMNAALDH1A1MAPK1
SCHEMBL3933983 0.89 FAAH (0.71) FAAHEPHX2LMNAALDH1A1TNF
SCHEMBL3931640 0.89 FAAH (0.73) FAAHEPHX2LMNAALDH1A1MAPK1
SCHEMBL3943262 0.88 FAAH (0.76) FAAHEPHX2LMNAALDH1A1MAPK1
SCHEMBL3936957 0.87 FAAH (0.75) FAAHEPHX2LMNAALDH1A1MAPK1
SCHEMBL3934482 0.87 FAAH (0.75) FAAHEPHX2LMNAALDH1A1MAPK1

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