SCHEMBL2847268

SCHEMBL2847268

COc1ccc(-n2nc(Oc3ccc(F)cc3F)oc2=O)cc1

nearest known ligand 0.75

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ABHD16A O95870 1/20 0.61
MGLL Q99685 2/20 0.53
FAAH O00519 1/20 0.53
NPBWR1 P48145 2/20 0.47
MCHR1 Q99705 1/20 0.47
ALDH1A1 P00352 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44

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
SCHEMBL2851911 0.86 ABHD16A (0.53) ABHD16ANPBWR1MCHR1
SCHEMBL2854275 0.85 ABHD16A (0.54) ABHD16AMGLLFAAHNPBWR1MCHR1
SCHEMBL2855537 0.84 ABHD16A (0.51) ABHD16AMGLLFAAHNPBWR1MCHR1
Hydrochloric Acid SCHEMBL2834123 0.84 ABHD16A (0.52) ABHD16AMGLLFAAHNPBWR1MCHR1
SCHEMBL2855611 0.82 ABHD16A (0.50) ABHD16AMGLLFAAHNPBWR1MCHR1
SCHEMBL2850915 0.82 ABHD16A (0.50) ABHD16AMGLLFAAHNPBWR1MCHR1
SCHEMBL2853190 0.81 ABHD16A (0.49) ABHD16AMGLLNPBWR1MCHR1ALDH1A1
SCHEMBL2855513 0.76 MGLL (0.55) ABHD16AMGLLFAAH
SCHEMBL3470631 0.75 DRD2 (0.41) ABHD16AMGLLFAAH
SCHEMBL2853266 0.75 MGLL (0.64) ABHD16AMGLLFAAHNPBWR1MCHR1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2238131-A1 5-O-SUBSTITUTED 3-N-PHENYL-1,3,4-OXADIAZOLONES FOR MEDICAL USE BIAL - Portela & Ca., S.A. (PT) 2010-10-13 EP disclosed
WO-2010074587-A2 5-O-SUBSTITUTED 3-N-ARYL-1,3,4-OXADIAZOLONES FOR MEDICAL USE BIAL - PORTELA & CA., S.A. (PT) 2010-07-01 WO disclosed
WO-2009084970-A1 5-O-SUBSTITUTED 3-N-PHENYL-1,3,4-OXADIAZOLONES FOR MEDICAL USE BIAL-PORTELA & COMPANHIA, S.A. (PT) 2009-07-09 WO disclosed