SCHEMBL27331995

SCHEMBL27331995

C=COC(C)=O.CC(C)(C)OC(=O)O

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.31
GAA P10253 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL29210394 0.86 DGAT1 (0.33) DGAT1
SCHEMBL28182390 0.84 ALDH1A1 (0.38) GAAALDH1A1
SCHEMBL28515007 0.83 ALDH1A1 (0.33) ALDH1A1
SCHEMBL10533072 0.83 KEAP1 (0.31)
Hydrogen Peroxide SCHEMBL27786199 0.83
Pivalate SCHEMBL9113550 0.82 ALDH1A1 (0.33) ALDH1A1
Pivalate SCHEMBL28007070 0.82 ALDH1A1 (0.33) ALDH1A1
SCHEMBL9278096 0.82 ALDH1A1 (0.38) ALDH1A1
Tert-Butanol SCHEMBL27539047 0.81 ALDH1A1 (0.36) GAAALDH1A1
SCHEMBL28114520 0.81 ALDH1A1 (0.36) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107083129-B Water-based ultrathin steel structure fireproof coating and preparation method thereof 南京长江涂料有限公司 2020-06-19 CN claimed
CN-1048265-C Surface modification of polymer objects BAUSCH & LOMB (US) 2000-01-12 CN disclosed
CN-1048025-C Surface coating of polymer objects BAUSCH & LOMB (US) 2000-01-05 CN disclosed
CN-1061786-A The surface coated of polymer articles BAUSCH & LOMB (US) 1992-06-10 CN disclosed
CN-1061785-A The surface modification of polymer articles BAUSCH & LOMB (US) 1992-06-10 CN disclosed