SCHEMBL9502844

SCHEMBL9502844

C=C(CC(=C)C(=O)OC)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
ALOX15 P16050 1/20 0.43
HSD17B10 Q99714 1/20 0.43
EGLN1 Q9GZT9 1/20 0.38
TET2 Q6N021 6/20 0.37
TET3 O43151 1/20 0.34
TET1 Q8NFU7 1/20 0.34
GRIK1 P39086 1/20 0.33
GRIK2 Q13002 1/20 0.33
GRM1 Q13255 1/20 0.33
GRM2 Q14416 1/20 0.33
TGFBR1 P36897 1/20 0.33
TSHR P16473 2/20 0.32

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
Itaconate SCHEMBL10984219 0.91 ALOX15 (0.56) ALDH1A1ALOX15HSD17B10EGLN1TET2
Itaconate SCHEMBL28337916 0.83 HSD17B10 (0.48) ALDH1A1ALOX15HSD17B10EGLN1TET2
SCHEMBL1300687 0.83 ALDH1A1 (0.44) ALDH1A1ALOX15HSD17B10EGLN1TET2
SCHEMBL60440 0.82 ALDH1A1 (0.48) ALDH1A1ALOX15HSD17B10EGLN1TET2
SCHEMBL1809603 0.81 ALOX15 (0.57) ALDH1A1ALOX15HSD17B10TET2TET3
SCHEMBL11694969 0.80 ALDH1A1 (0.46) ALDH1A1ALOX15HSD17B10EGLN1TET2
Ammonia Solution, Strong SCHEMBL27793329 0.80 ALDH1A1 (0.46) ALDH1A1ALOX15HSD17B10EGLN1TET2
Ethylene SCHEMBL27718140 0.80 ALDH1A1 (0.46) ALDH1A1ALOX15HSD17B10EGLN1TET2
SCHEMBL11696832 0.80 ALDH1A1 (0.46) ALDH1A1ALOX15HSD17B10EGLN1TET2
SCHEMBL353003 0.79 ALDH1A1 (0.41) ALDH1A1ALOX15HSD17B10EGLN1TET2

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-0135280-B1 NEW POLYMERIZATION PROCESS AND POLYMERS PRODUCED THEREBY COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 1993-05-12 EP disclosed
US-4581429-A Polymerization process and polymers produced thereby COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANIZATION (AU) 1986-04-08 US disclosed
EP-0135280-A2 New polymerization process and polymers produced thereby COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 1985-03-27 EP disclosed