SCHEMBL8518226

SCHEMBL8518226

C=C(C)C(=O)OC.C=C(OC(C)=O)C(=O)OC

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.68
TDP1 Q9NUW8 2/20 0.44
HSD17B10 Q99714 1/20 0.44
TSHR P16473 4/20 0.39
THRB P10828 1/20 0.32
MAPT P10636 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
SCHEMBL1335211 0.93 ALDH1A1 (0.55) ALDH1A1TDP1HSD17B10TSHRMAPT
SCHEMBL10636466 0.83
SCHEMBL4390490 0.83 ALDH1A1 (1.00) ALDH1A1TDP1HSD17B10TSHRTHRB
SCHEMBL1849 0.83
SCHEMBL16442916 0.80 ALDH1A1 (0.83) ALDH1A1TDP1HSD17B10TSHRTHRB
Hydrogen Peroxide SCHEMBL9143793 0.80
SCHEMBL2168919 0.80
SCHEMBL20681605 0.80
SCHEMBL21340366 0.80
Methyl Alcohol SCHEMBL1272141 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5973094-A Functional polymers WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 1999-10-26 US disclosed
EP-0794199-A2 Novel functional polymers WAKO PURE CHEMICAL INDUSTRIES, LTD (JP) 1997-09-10 EP disclosed