SCHEMBL29210205

SCHEMBL29210205

CCC=C(C(=O)O)C(=CCC)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 1/20 0.46
GRIK1 P39086 2/20 0.41
GRIK2 Q13002 2/20 0.41
FFAR3 O14843 2/20 0.37
HDAC3 O15379 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
ALDH1A1 P00352 3/20 0.32
TDP1 Q9NUW8 3/20 0.32
MAPK1 P28482 1/20 0.32
FFAR1 O14842 1/20 0.31
MAPT P10636 1/20 0.31
CYP19A1 P11511 1/20 0.31
RXRA P19793 1/20 0.31
PPARG P37231 1/20 0.31
OXER1 Q8TDS5 1/20 0.31
GABRR1 P24046 1/20 0.31
LMNA P02545 1/20 0.30

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
SCHEMBL190066 0.94 EP300 (0.52) EP300GRIK1GRIK2FFAR3HDAC3
SCHEMBL243912 0.92 EP300 (0.41) EP300GRIK1GRIK2FFAR3
SCHEMBL28880870 0.89 EP300 (0.40) EP300GRIK1GRIK2FFAR3
SCHEMBL28881651 0.89 EP300 (0.40) EP300GRIK1GRIK2FFAR3
SCHEMBL28880872 0.89 EP300 (0.40) EP300GRIK1GRIK2FFAR3
Diethylamine SCHEMBL27873531 0.87 EP300 (0.39) EP300GRIK1GRIK2ALDH1A1TDP1
SCHEMBL1977291 0.86 EP300 (0.41) EP300GRIK1GRIK2FFAR3ALDH1A1
SCHEMBL27985112 0.84 GRIK1 (0.41) EP300GRIK1GRIK2FFAR3GABRR1
SCHEMBL1135184 0.84 GRIK1 (0.41) EP300GRIK1GRIK2FFAR3GABRR1
SCHEMBL5328014 0.82 GRIK1 (0.39) EP300GRIK1GRIK2GABRR1

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-117820954-A Water-based acrylic polyurethane finish paint and preparation method thereof 山东中胜涂料有限公司 2024-04-05 CN disclosed