SCHEMBL9956264

SCHEMBL9956264

COc1cnc2c(c1)c(C(=O)C(=O)Nc1ccnc(OC)c1)c(C)n2Cc1ncc(Cl)s1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.55
SCN10A Q9Y5Y9 1/20 0.35
NR3C1 P04150 1/20 0.33
PLA2G2A P14555 1/20 0.32
PPARG P37231 4/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.32
TYK2 P29597 1/20 0.32
CNR1 P21554 1/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
RXFP1 Q9HBX9 2/20 0.31
TP53 P04637 1/20 0.31
MAPT P10636 1/20 0.31
MAPK3 P27361 1/20 0.31
KCNK3 O14649 1/20 0.31
KCNK9 Q9NPC2 1/20 0.31
P2RX3 P56373 1/20 0.31
WNT1 P04628 1/20 0.31

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
SCHEMBL9960003 0.94 FAAH (0.59) FAAHSCN10ANR3C1PPARGPTGDR2
SCHEMBL9959139 0.89 FAAH (0.65) FAAHPLA2G2APTGDR2MEN1NPC1
SCHEMBL9959066 0.87 FAAH (0.72) FAAHPLA2G2APTGDR2CNR1MEN1
SCHEMBL9956255 0.85 FAAH (0.75) FAAHSCN10APLA2G2APTGDR2MEN1
SCHEMBL9960034 0.85 FAAH (0.62) FAAHSCN10APLA2G2AMAPT
SCHEMBL10242361 0.85 FAAH (0.62) FAAHSCN10APLA2G2ACNR1MAPT
SCHEMBL9959182 0.85 FAAH (0.71) FAAHSCN10APLA2G2APTGDR2CNR1
SCHEMBL9959314 0.85 FAAH (0.59) FAAHSCN10ANR3C1CNR1MAPT
SCHEMBL9958535 0.84 FAAH (0.54) FAAHSCN10ANR3C1PLA2G2APPARG
SCHEMBL9952599 0.84 FAAH (0.59) FAAHSCN10APLA2G2APPARGCNR1

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-2012088431-A1 FAAH INHIBITORS IRONWOOD PHARMACEUTICALS, INC. (US) 2012-06-28 WO disclosed
WO-2012088431-A1 FAAH INHIBITORS IRONWOOD PHARMACEUTICALS, INC. (US) 2012-06-28 WO disclosed