SCHEMBL29129689

SCHEMBL29129689

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

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35
PTGS1 P23219 1/20 0.32
AKR1C3 P42330 1/20 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
SCHEMBL6726270 0.79 ALDH1A1 (0.38) ALDH1A1TSHRPTGS1AKR1C3
SCHEMBL1074949 0.79 ALDH1A1 (0.38) ALDH1A1TSHRPTGS1AKR1C3
SCHEMBL3471622 0.77 PTGS1 (0.33) ALDH1A1TSHRPTGS1AKR1C3
SCHEMBL6571066 0.76 PTGS1 (0.36) ALDH1A1TSHRPTGS1AKR1C3
SCHEMBL22811 0.76 GRIK1 (0.39) ALDH1A1TSHRPTGS1AKR1C3
SCHEMBL6571057 0.76 PTGS1 (0.36) ALDH1A1TSHRPTGS1AKR1C3
SCHEMBL27166 0.76 GRIK1 (0.39) ALDH1A1TSHRPTGS1AKR1C3
SCHEMBL10895044 0.74 PTGS1 (0.34) ALDH1A1TSHRPTGS1AKR1C3
SCHEMBL4146429 0.73 ALDH1A1 (0.33) ALDH1A1TSHRPTGS1AKR1C3
SCHEMBL9055342 0.72 PTGS1 (0.33) ALDH1A1TSHRPTGS1AKR1C3

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
CN-116947630-A Method for continuously manufacturing 1-ethanol methacrylate in microchannel reactor 上海吉奉生物科技有限公司 2023-10-27 CN claimed