SCHEMBL6234776

SCHEMBL6234776

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

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
ALOX15 P16050 1/20 0.40
ALDH1A1 P00352 3/20 0.39
TSHR P16473 1/20 0.39
TET2 Q6N021 4/20 0.34
TET3 O43151 1/20 0.32
TET1 Q8NFU7 1/20 0.32
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
GRIK1 P39086 1/20 0.31
GRIK2 Q13002 1/20 0.31
GRM1 Q13255 1/20 0.31
GRM2 Q14416 1/20 0.31

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
SCHEMBL27216267 0.86 HSD17B10 (0.44) HSD17B10TDP1ALOX15ALDH1A1TET2
SCHEMBL28088694 0.85 ALOX15 (0.46) HSD17B10ALOX15ALDH1A1TET2TET3
SCHEMBL10352154 0.83 ALDH1A1 (0.44) HSD17B10TDP1ALOX15ALDH1A1TSHR
SCHEMBL11432063 0.82 HSD17B10 (0.44) HSD17B10TDP1ALDH1A1TSHRMGAM
SCHEMBL28271838 0.80 ALDH1A1 (0.46) HSD17B10TDP1ALDH1A1TSHRTET2
SCHEMBL60441 0.78 MGAM (0.48) HSD17B10ALOX15ALDH1A1TSHRTET2
SCHEMBL20239703 0.78 ALOX15 (0.34) HSD17B10ALOX15ALDH1A1
SCHEMBL9683529 0.77 ALOX15 (0.40) HSD17B10ALOX15TET2TET3TET1
SCHEMBL4013444 0.77 ALDH1A1 (0.56) HSD17B10TDP1ALDH1A1TSHRMGAM
SCHEMBL10984229 0.77 MGAM (0.38) HSD17B10ALOX15ALDH1A1TSHRTET2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1021469-B1 RELEASE COATING FOR ADHESIVE ARTICLES AND METHOD MINNESOTA MINING & MFG (US) 2005-05-25 EP disclosed
EP-1021469-A1 RELEASE COATING FOR ADHESIVE ARTICLES AND METHOD MINNESOTA MINING AND MANUFACTURING COMPANY (US) 2000-07-26 EP disclosed
US-5990238-A AN ADDITION POLYMER, E.G POLYVINYL ALCOHOL, MODIFIED BY A ALKYL ISOCYANATE AND A WATER-SOLUBIZING ANHYDRIDE; NEUTRALIZATION; ANIONIC POLYMERS; FILMS; PRESSURE SENSITIVE ADHESIVES; BACKINGS; STORAGE 3M INNOVATIVE PROPERTIES COMPANY (US) 1999-11-23 US disclosed
WO-1999015568-A1 RELEASE COATING FOR ADHESIVE ARTICLES AND METHOD MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1999-04-01 WO disclosed