SCHEMBL7769875

SCHEMBL7769875

CCCCCC(N)C([NH])=O

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.50
GRIK2 Q13002 2/20 0.50
DPP7 Q9UHL4 2/20 0.50
SLC1A2 P43004 1/20 0.50
SLC1A1 P43005 1/20 0.50
GNAI3 P08754 1/20 0.47
GNAO1 P09471 1/20 0.47
GNAI1 P63096 1/20 0.47
LAP3 P28838 2/20 0.47
TP53 P04637 1/20 0.47
OPRM1 P35372 1/20 0.46
SLC15A1 P46059 1/20 0.46
GPR84 Q9NQS5 3/20 0.43
SPHK1 Q9NYA1 1/20 0.43
FFAR1 O14842 1/20 0.43
CA1 P00915 1/20 0.43

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
SCHEMBL7771462 0.93
SCHEMBL9579113 0.93
SCHEMBL9579082 0.83
SCHEMBL1262429 0.83
SCHEMBL2730539 0.79 GRIK1 (0.68) GRIK1GRIK2SLC1A2SLC1A1GPR84
SCHEMBL5498757 0.79 GSR (0.64) DPP7GNAI3GNAO1GNAI1
SCHEMBL1814169 0.79 GRIK1 (0.52) GRIK1GRIK2DPP7SLC1A2SLC1A1
SCHEMBL16326700 0.79 GRIK1 (0.52) GRIK1GRIK2DPP7SLC1A2SLC1A1
SCHEMBL21929716 0.79 GRIK1 (0.52) GRIK1GRIK2DPP7SLC1A2SLC1A1
SCHEMBL38735 0.79 GRIK1 (0.68) GRIK1GRIK2SLC1A2SLC1A1GPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0747381-B1 CARBAPENEM DERIVATIVE BANYU PHARMA CO LTD (JP) 2001-10-31 EP disclosed
EP-0765879-B1 13-Substituted milbemycin 5-oxime derivatives, their preparation and their use against insects and other pests SANKYO CO (JP) 2001-02-14 EP disclosed
EP-0675133-B1 13-Substituted milbemycin derivatives, their preparation and use SANKYO CO (JP) 2000-01-12 EP disclosed
US-5861429-A MITICIDES AND ANTHELMINTICS SANKYO COMPANY, LIMITED (JP) 1999-01-19 US disclosed
US-5707987-A BACTERICIDE ANTIBIOTICS BANYU PHARMACEUTICAL CO., LTD. (JP) 1998-01-13 US disclosed
EP-0765879-A1 13-Substituted milbemycin 5-oxime derivatives, their preparation and their use against insects and other pests SANKYO COMPANY LIMITED (JP) 1997-04-02 EP disclosed
US-5614470-A AGRICULTURAL ANTHELMINTIC, ACARICIDE, INSECTICIDE SANKYO COMPANY, LIMITED (JP) 1997-03-25 US disclosed
EP-0747381-A1 CARBAPENEM DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 1996-12-11 EP disclosed
EP-0675133-A1 13-Substituted milbemycin derivatives, their preparation and use SANKYO COMPANY LIMITED (JP) 1995-10-04 EP disclosed