SCHEMBL29030435

SCHEMBL29030435

CCCC=C(CC)C(=O)OO

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.39
GRIK2 Q13002 1/20 0.39
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL4627059 0.86 GRIK1 (0.41) GRIK1GRIK2ALDH1A1
SCHEMBL4627053 0.86 GRIK1 (0.41) GRIK1GRIK2ALDH1A1
SCHEMBL29030430 0.85 GRIK1 (0.38) GRIK1GRIK2ALDH1A1
SCHEMBL7655559 0.84 GRIK1 (0.40) GRIK1GRIK2ALDH1A1
SCHEMBL7655562 0.84 GRIK1 (0.40) GRIK1GRIK2ALDH1A1
SCHEMBL2045454 0.84 EP300 (0.48)
SCHEMBL27919955 0.83 GRIK1 (0.39) GRIK1GRIK2ALDH1A1
SCHEMBL6044981 0.82 GRIK1 (0.35) GRIK1GRIK2
SCHEMBL8206951 0.81 NPSR1 (0.41) GRIK1GRIK2ALDH1A1
SCHEMBL28788445 0.81 GRIK1 (0.38) GRIK1GRIK2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116410367-A Catalyst system for ethylene polymerization and preparation method and application thereof 中国石油天然气股份有限公司 2023-07-11 CN claimed
CN-116410365-A Polypropylene catalyst and preparation method and application thereof 中国石油天然气股份有限公司 2023-07-11 CN disclosed