SCHEMBL3932027

SCHEMBL3932027

c1ccc(CN2CCc3c(ccnc3Nc3ccc4ncccc4c3)C2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FAAH O00519 11/20 1.00
MEN1 O00255 1/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
KMT2A Q03164 1/20 0.47
MKNK1 Q9BUB5 5/20 0.42
ABCB1 P08183 1/20 0.41
ABCG2 Q9UNQ0 1/20 0.41
HTR7 P34969 1/20 0.41
HTR6 P50406 1/20 0.41
BRS3 P32247 1/20 0.41

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
SCHEMBL3936220 0.89 FAAH (1.00) FAAHMEN1NPC1RAB9AKMT2A
SCHEMBL3941123 0.84 FAAH (0.86) FAAHMEN1NPC1RAB9AKMT2A
SCHEMBL3935343 0.83 FAAH (0.89) FAAHMEN1NPC1RAB9AKMT2A
SCHEMBL3939066 0.83 FAAH (0.82) FAAHMEN1NPC1RAB9AKMT2A
SCHEMBL3933752 0.83 FAAH (0.89) FAAHMEN1NPC1RAB9AKMT2A
SCHEMBL3935112 0.83 FAAH (0.87) FAAHMEN1NPC1RAB9AKMT2A
SCHEMBL3933423 0.83 FAAH (0.87) FAAHMEN1NPC1RAB9AKMT2A
SCHEMBL3935920 0.82 FAAH (0.86) FAAHMEN1NPC1RAB9AKMT2A
SCHEMBL3943345 0.81 FAAH (0.70) FAAHMKNK1BRS3
SCHEMBL3941489 0.81 FAAH (0.83) FAAHMEN1NPC1RAB9AKMT2A

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