SCHEMBL28066899

SCHEMBL28066899

CCCCCCC/C=C(\CCOCC)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 1/20 0.51
GRIK1 P39086 1/20 0.43
PPARG P37231 7/20 0.42
PPARA Q07869 4/20 0.42
TERT O14746 3/20 0.42
PTPN1 P18031 3/20 0.42
PPARD Q03181 3/20 0.42
TOP1 P11387 3/20 0.42
MAPT P10636 2/20 0.42
BLM P54132 2/20 0.42
HSD17B10 Q99714 2/20 0.42
FABP4 P15090 2/20 0.42
GMNN O75496 1/20 0.42
USP2 O75604 1/20 0.42
LMNA P02545 1/20 0.42
CYP1A2 P05177 1/20 0.42
POLB P06746 1/20 0.42
CYP2C9 P11712 1/20 0.42
ALOX15 P16050 1/20 0.42
APEX1 P27695 1/20 0.42

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
SCHEMBL9446544 0.85 EP300 (0.53) EP300GRIK1PPARGPPARATERT
SCHEMBL28066860 0.85 EP300 (0.53) EP300GRIK1PPARGPPARATERT
SCHEMBL7047628 0.83 EP300 (0.62) EP300GRIK1PPARGPPARATERT
SCHEMBL11027652 0.83 EP300 (0.62) EP300GRIK1PPARGPPARATERT
SCHEMBL1077925 0.83 EP300 (0.62) EP300GRIK1PPARGPPARATERT
SCHEMBL25297773 0.83 EP300 (0.62) EP300GRIK1PPARGPPARATERT
SCHEMBL3421630 0.83 EP300 (0.62) EP300GRIK1PPARGPPARATERT
SCHEMBL20954083 0.83 EP300 (0.62) EP300GRIK1PPARGPPARATERT
SCHEMBL20954084 0.83 EP300 (0.62) EP300GRIK1PPARGPPARATERT
SCHEMBL23086204 0.83 EP300 (0.62) EP300GRIK1PPARGPPARATERT

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
CN-103189350-B Trans-2-decenoic acid derivative and drug containing same NAGOYA INDUSTRIAL SCIENCE RESRARCH INSTITUTE (JP) 2016-04-27 CN disclosed