SCHEMBL8422265

SCHEMBL8422265

OC(c1ccc(OCC2CC2)cc1)c1cncnc1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACACB O00763 6/20 0.44
PARP15 Q460N3 4/20 0.44
PARP10 Q53GL7 4/20 0.44
PARP2 Q9UGN5 2/20 0.44
LTA4H P09960 1/20 0.40
GPR88 Q9GZN0 1/20 0.39
FFAR1 O14842 1/20 0.39

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
SCHEMBL14033727 0.81 GPR88 (0.54) PARP15PARP10PARP2LTA4HGPR88
SCHEMBL4525746 0.77 PARP15 (0.54) ACACBPARP15PARP10PARP2GPR88
SCHEMBL30932889 0.74 PARP15 (0.51) ACACBPARP15PARP10PARP2GPR88
SCHEMBL29024848 0.73 PARP15 (0.64) PARP15PARP10PARP2
SCHEMBL10702959 0.73 VNN1 (0.45)
SCHEMBL21910441 0.72 PARP15 (0.49) ACACBPARP15PARP10PARP2GPR88
SCHEMBL10014749 0.71 PARP15 (0.50) ACACBPARP15PARP10PARP2GPR88
SCHEMBL19876587 0.68 PARP15 (0.51) ACACBPARP15PARP10PARP2GPR88
SCHEMBL7601081 0.68 PARP15 (0.51) ACACBPARP15PARP10PARP2GPR88
SCHEMBL17246825 0.68 PARP15 (0.51) ACACBPARP15PARP10PARP2GPR88

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
EP-0945065-A1 CROP-SELECTIVE HERBICIDES SANKYO COMPANY LIMITED (JP) 1999-09-29 EP disclosed