SCHEMBL9480412

SCHEMBL9480412

CCCC(N)OC(=O)C(=O)OC(N)CCC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A2 P43004 3/20 0.39
SLC1A1 P43005 3/20 0.39
SLC1A3 P43003 2/20 0.39
GRIK1 P39086 2/20 0.39
GRIK2 Q13002 2/20 0.39
CHRM1 P11229 1/20 0.39
AKR1A1 P14550 1/20 0.39
CHRM3 P20309 1/20 0.39
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
ADRA1A P35348 1/20 0.39
HRH1 P35367 1/20 0.39
DRD3 P35462 1/20 0.39
SLC6A3 Q01959 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
CYP3A4 P08684 2/20 0.37
TSHR P16473 2/20 0.37
NFKB1 P19838 2/20 0.37

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
SCHEMBL28276532 0.93 HDAC7 (0.35) SLC1A2SLC1A1SLC1A3GRIK1GRIK2
SCHEMBL9482413 0.85 SLC1A2 (0.39) SLC1A2SLC1A1SLC1A3GRIK1GRIK2
SCHEMBL1033366 0.85 ALDH1A1 (0.43) SLC1A2SLC1A1SLC1A3GRIK1GRIK2
SCHEMBL4630307 0.84 GRIK1 (0.48) SLC1A2SLC1A1SLC1A3GRIK1GRIK2
Butane SCHEMBL1033068 0.83 ALDH1A1 (0.41) SLC1A2SLC1A1SLC1A3GRIK1GRIK2
SCHEMBL933721 0.83
SCHEMBL27703023 0.83
SCHEMBL5968376 0.82 GRIK1 (0.50) SLC1A2SLC1A1GRIK1GRIK2TP53
SCHEMBL1401796 0.82 GRIK1 (0.50) SLC1A2SLC1A1GRIK1GRIK2TP53
SCHEMBL27918872 0.82 GRIK1 (0.50) SLC1A2SLC1A1GRIK1GRIK2TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104254535-A SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINES, THEIR PREPARATION AND USE AS MEDICAMENTS ESTEVE LABOR DR 2014-12-31 CN claimed
JP-5119186-A None JP disclosed
CN-105461693-A Crth2 antagonist compound and use thereof GUANGDONG HEC PHARMACEUTICAL 2016-04-06 CN disclosed
CN-104254535-A SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINES, THEIR PREPARATION AND USE AS MEDICAMENTS ESTEVE LABOR DR 2014-12-31 CN disclosed
JP-H05119186-A METHOD FOR REGENERATING REPROCESSED ORGANIC SOLVENT JAPAN ATOM ENERGY RES INST 1993-05-18 JP disclosed