SCHEMBL8101889

SCHEMBL8101889

COC(C)C(C)(C)OC(=O)/C=C/C(=O)OC(C)(C)C(C)OC

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 3/20 0.39
KEAP1 Q14145 1/20 0.39
NFE2L2 Q16236 1/20 0.39

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
SCHEMBL8101892 0.92 HCAR2 (0.47) HCAR2KEAP1NFE2L2
SCHEMBL11747549 0.81 HCAR2 (0.39) HCAR2KEAP1NFE2L2
SCHEMBL11746578 0.81 HCAR2 (0.39) HCAR2KEAP1NFE2L2
SCHEMBL4583811 0.81 HCAR2 (0.39) HCAR2KEAP1NFE2L2
SCHEMBL10557445 0.77 HCAR2 (0.33) HCAR2KEAP1NFE2L2
SCHEMBL11747197 0.76 HCAR2 (0.35) HCAR2KEAP1NFE2L2
SCHEMBL11748626 0.76 HCAR2 (0.35) HCAR2KEAP1NFE2L2
SCHEMBL9709360 0.75 HCAR2 (0.36) HCAR2KEAP1NFE2L2
SCHEMBL11747544 0.74 HCAR2 (0.54) HCAR2KEAP1NFE2L2
SCHEMBL8427632 0.74 HCAR2 (0.54) HCAR2KEAP1NFE2L2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1006130-A1 Fumaric acid diester resin composition, cross-linked fumaric acid diester resin and process NOF CORPORATION (JP) 2000-06-07 EP disclosed