SCHEMBL8926744

SCHEMBL8926744

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

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 8/20 0.59
MAPK1 P28482 2/20 0.59
CA1 P00915 4/20 0.52
SLC1A2 P43004 2/20 0.42
SLC1A1 P43005 2/20 0.42
SLC1A3 P43003 1/20 0.42
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
USP2 O75604 1/20 0.37
GRIK1 P39086 2/20 0.37
GRIK2 Q13002 2/20 0.37
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

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
SCHEMBL3014658 0.84 CA2 (0.68) CA2MAPK1CA1SLC1A2SLC1A1
SCHEMBL1987890 0.81 CA2 (0.70) CA2MAPK1CA1SLC1A2SLC1A1
SCHEMBL4946235 0.80 CA2 (0.63) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL13721090 0.77 CA2 (0.77) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL2031757 0.76 CA2 (0.74) CA2MAPK1CA1SLC1A2SLC1A1
SCHEMBL3261112 0.75 CA2 (0.56) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL28034545 0.75 CA2 (0.91) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL5750600 0.75 CA2 (0.91) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL8375903 0.74 CA2 (1.00) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL301319 0.74 CA2 (1.00) CA2MAPK1CA1SLC1A2SLC1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5623004-A REACTION PRODUCT OF DIGLYCIDYL ETHER OF DIHYDRIC PHENOL AND EXCESS DIHYDRIC PHENOL HAVING PENDANT POLYALKYLENE OXIDE CHAIN AND PENDANT POLYUNSATURATED ACID CHAIN THE DOW CHEMICAL COMPANY (US) 1997-04-22 US disclosed
US-5426139-A Curable phenolic resins and polyethers; protective coating for food and beverage cans; flexible, solvent resistance THE DOW CHEMICAL COMPANY (US) 1995-06-20 US disclosed
US-4273851-A Method of coating using photopolymerizable latex systems RICHARDSON GRAPHICS COMPANY (US) 1981-06-16 US disclosed
US-4224398-A Photopolymerizable latex systems RICHARDSON GRAPHICS COMPANY (US) 1980-09-23 US disclosed
US-4186069-A PARTICLES OF WATER-INSOLUBLE POLYMERS IN COMBINATION WITH WATER-SOLUBLE, LIGHT-SENSITIVE POLYMERS RICHARDSON GRAPHICS COMPANY (US) 1980-01-29 US disclosed
US-4141867-A CHLOROACETOXYALKYL ACRYLATE INTERNAL CROSSLINKING AGENT, POLYAMINOAMINE DEUTSCHE TEXACO AKTIENGESELLSCHAFT (DE) 1979-02-27 US disclosed