SCHEMBL7562280

SCHEMBL7562280

CCCC/C=C(\CCCC)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.58
EP300 Q09472 1/20 0.50
F7 P08709 2/20 0.44
F3 P13726 2/20 0.44
GRIK2 Q13002 1/20 0.43
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
APEX1 P27695 2/20 0.41
TERT O14746 3/20 0.39
PTPN1 P18031 3/20 0.39
PPARG P37231 3/20 0.39
PPARD Q03181 3/20 0.39
PPARA Q07869 3/20 0.39
MAPT P10636 2/20 0.39
BLM P54132 2/20 0.39
HSD17B10 Q99714 2/20 0.39
FABP4 P15090 2/20 0.39
TOP1 P11387 2/20 0.39
GMNN O75496 1/20 0.39
USP2 O75604 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
SCHEMBL811158 1.00 GRIK1 (0.58) GRIK1EP300F7F3GRIK2
SCHEMBL4375273 1.00 GRIK1 (0.58) GRIK1EP300F7F3GRIK2
SCHEMBL21635667 0.98 GRIK1 (0.56) GRIK1EP300F7F3GRIK2
SCHEMBL21635676 0.98 GRIK1 (0.56) GRIK1EP300F7F3GRIK2
SCHEMBL21635651 0.98 GRIK1 (0.56) GRIK1EP300F7F3GRIK2
SCHEMBL6687982 0.94 EP300 (0.59) GRIK1EP300F7F3APEX1
SCHEMBL6687987 0.94 EP300 (0.59) GRIK1EP300F7F3APEX1
SCHEMBL10869040 0.92 EP300 (0.62) GRIK1EP300F7F3APEX1
SCHEMBL8336993 0.92 EP300 (0.62) GRIK1EP300F7F3APEX1
SCHEMBL3711652 0.92 EP300 (0.62) GRIK1EP300F7F3APEX1

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-1227111-A1 TRIPHENYLBORON-CONTAINING POLYMERS AND USE THEREOF Yoshitomi Fine Chemicals, Ltd. (JP) 2002-07-31 EP disclosed