SCHEMBL3458455

SCHEMBL3458455

O=c1oc(Oc2ccc(O)cc2)nn1-c1ccc(Cl)nc1

nearest known ligand 0.73

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.46
MGLL Q99685 1/20 0.46
NPBWR1 P48145 4/20 0.42
MCHR1 Q99705 2/20 0.42

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
SCHEMBL3458114 0.88 MGLL (0.55) FAAHMGLLNPBWR1MCHR1
SCHEMBL2854103 0.85 FAAH (0.53) FAAHMGLLNPBWR1MCHR1
SCHEMBL2853266 0.72 MGLL (0.64) FAAHMGLLNPBWR1MCHR1
SCHEMBL28438899 0.69 MEN1 (0.56)
SCHEMBL2855348 0.68 MGLL (0.71) FAAHMGLL
SCHEMBL9553638 0.68 MGLL (0.60) FAAHMGLL
SCHEMBL7044439 0.68 MGLL (0.78) FAAHMGLLNPBWR1
SCHEMBL2856529 0.66 MGLL (0.67) FAAHMGLL
SCHEMBL7044899 0.66 MGLL (0.59) FAAHMGLLNPBWR1MCHR1
SCHEMBL9553707 0.66 MGLL (0.56) FAAHMGLL

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-2010151160-A1 O-SUBSTITUTED 3-N-HETEROARYL-1,3,4-OXADIAZOLONES FOR MEDICAL USE BIAL - PORTELA & CA., S.A. (PT) 2010-12-29 WO claimed
WO-2010151160-A1 O-SUBSTITUTED 3-N-HETEROARYL-1,3,4-OXADIAZOLONES FOR MEDICAL USE BIAL - PORTELA & CA., S.A. (PT) 2010-12-29 WO disclosed