SCHEMBL16248471

SCHEMBL16248471

CCCCC(CC(=O)OCC(CC)(CO)CO)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 6/20 0.46
MAPK1 P28482 1/20 0.46
SLC1A2 P43004 2/20 0.41
SLC1A1 P43005 2/20 0.41
SLC1A3 P43003 1/20 0.41
CA1 P00915 3/20 0.39
GRIK1 P39086 2/20 0.36
GRIK2 Q13002 2/20 0.36
TDP1 Q9NUW8 2/20 0.35
CHRM1 P11229 1/20 0.35
AKR1A1 P14550 1/20 0.35
CHRM3 P20309 1/20 0.35
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
ADRA1A P35348 1/20 0.35
HRH1 P35367 1/20 0.35
DRD3 P35462 1/20 0.35
SLC6A3 Q01959 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC2 Q92769 1/20 0.35

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
SCHEMBL1104299 0.87 CA2 (0.51) CA2MAPK1SLC1A2SLC1A1SLC1A3
SCHEMBL1104243 0.81 CA2 (0.45) CA2MAPK1SLC1A2SLC1A1CA1
SCHEMBL5557476 0.79 CA2 (0.57) CA2MAPK1SLC1A2SLC1A1SLC1A3
SCHEMBL1004665 0.78 CA2 (0.56) CA2MAPK1SLC1A2SLC1A1SLC1A3
SCHEMBL16248472 0.78 GABRR1 (0.33) MAPK1CYP3A4
SCHEMBL21561686 0.78 NOD1 (0.37) HSD17B10TSHRRECQLMEN1KMT2A
SCHEMBL1061357 0.78 CA2 (0.55) CA2MAPK1SLC1A2SLC1A1SLC1A3
SCHEMBL5136353 0.78 TLR4 (0.45) TDP1HSD17B10TSHRKDM4ERECQL
SCHEMBL5137339 0.78 TLR4 (0.45) TDP1HSD17B10TSHRKDM4ERECQL
SCHEMBL8212027 0.78 GRIK1 (0.44) CA2MAPK1SLC1A2SLC1A1SLC1A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2810784-A1 RESIN COMPOSITION FOR LASER-ENGRAVABLE FLEXOGRAPHIC PRINTING PLATE, ORIGINAL PLATE FOR LASER-ENGRAVABLE FLEXOGRAPHIC PRINTING PLATE AND METHOD FOR PRODUCTION THEREOF, AND FLEXOGRAPHIC PRINTING PLATE AND METHOD FOR PRODUCTION THEREOF Fujifilm Corporation (JP) 2014-12-10 EP disclosed
US-20140338550-A1 RESIN COMPOSITION FOR LASER-ENGRAVABLE FLEXOGRAPHIC PRINTING PLATE, FLEXOGRAPHIC PRINTING PLATE PRECURSOR FOR LASER-ENGRAVABLE AND PROCESS FOR PRODUCING SAME, AND FLEXOGRAPHIC PRINTING PLATE AND PROCESS FOR MAKING SAME FUJIFILM CORPORATION (JP) 2014-11-20 US disclosed
US-20140338550-A1 RESIN COMPOSITION FOR LASER-ENGRAVABLE FLEXOGRAPHIC PRINTING PLATE, FLEXOGRAPHIC PRINTING PLATE PRECURSOR FOR LASER-ENGRAVABLE AND PROCESS FOR PRODUCING SAME, AND FLEXOGRAPHIC PRINTING PLATE AND PROCESS FOR MAKING SAME FUJIFILM CORPORATION (JP) 2014-11-20 US disclosed