SCHEMBL3942437

SCHEMBL3942437

O=S(=O)(c1ccc(F)cc1)N1CCc2c(ccnc2Nc2cnc3ccccc3c2)C1

nearest known ligand 0.88

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FAAH O00519 11/20 0.88
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
PKM P14618 2/20 0.44
LMNA P02545 2/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
KDM4E B2RXH2 1/20 0.40
MAPT P10636 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
GBA1 P04062 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
SCHEMBL3932491 0.94 FAAH (0.83) FAAHMEN1KMT2APKMLMNA
SCHEMBL3941135 0.94 FAAH (1.00) FAAHMEN1KMT2ALMNAALDH1A1
SCHEMBL3930792 0.92 FAAH (0.80) FAAHMEN1KMT2ALMNAALDH1A1
SCHEMBL3934243 0.92 FAAH (0.83) FAAHMEN1KMT2ALMNAALDH1A1
SCHEMBL3930701 0.92 FAAH (0.86) FAAHMEN1KMT2ALMNAALDH1A1
SCHEMBL3933839 0.92 FAAH (0.86) FAAHMEN1KMT2ALMNAALDH1A1
SCHEMBL3933960 0.92 FAAH (0.86) FAAHLMNAALDH1A1MAPK1HTT
SCHEMBL3936263 0.92 FAAH (0.90) FAAHMEN1KMT2ALMNAALDH1A1
SCHEMBL3941586 0.92 FAAH (0.86) FAAHMEN1KMT2ALMNAALDH1A1
SCHEMBL3941343 0.92 FAAH (0.86) FAAHMEN1KMT2APKMLMNA

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