SCHEMBL3470631

SCHEMBL3470631

O=c1oc(Oc2ccc(F)cc2F)nn1-c1ccc(OCC2CCN(c3ncccn3)CC2)cc1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.41
DRD4 P21917 1/20 0.41
ABHD16A O95870 1/20 0.39
KDM4E B2RXH2 1/20 0.37
DPP4 P27487 1/20 0.36
DPP8 Q6V1X1 1/20 0.36
DPP9 Q86TI2 1/20 0.36
DPP7 Q9UHL4 1/20 0.36
FAAH O00519 1/20 0.36
MGLL Q99685 1/20 0.36

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
SCHEMBL2855537 0.73 ABHD16A (0.51) ABHD16AFAAHMGLL
SCHEMBL2851911 0.73 ABHD16A (0.53) ABHD16A
SCHEMBL3467300 0.69 GPR4 (0.43)
SCHEMBL2854275 0.67 ABHD16A (0.54) ABHD16AFAAHMGLL
SCHEMBL2850915 0.66 ABHD16A (0.50) ABHD16AFAAHMGLL
SCHEMBL2858427 0.66 ABHD16A (0.64) ABHD16AMGLL
SCHEMBL2855611 0.64 ABHD16A (0.50) ABHD16AFAAHMGLL
SCHEMBL2853190 0.64 ABHD16A (0.49) ABHD16AMGLL
SCHEMBL2853363 0.64 ABHD16A (0.44) ABHD16AMGLL
SCHEMBL2855513 0.63 MGLL (0.55) ABHD16AFAAHMGLL

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-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