SCHEMBL28823966

SCHEMBL28823966

COC(=O)C(=O)CC1CO1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
TET2 Q6N021 1/20 0.30
EGLN1 Q9GZT9 1/20 0.30
PKM P14618 1/20 0.30
BCHE P06276 1/20 0.30

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
SCHEMBL19194252 0.79 ALDH1A1 (0.39) ALDH1A1TP53CYP3A4
SCHEMBL674835 0.79 ALDH1A1 (0.47) ALDH1A1TP53CYP3A4
Ethylene SCHEMBL28096383 0.78 ALDH1A1 (0.46) ALDH1A1TP53CYP3A4
SCHEMBL28122792 0.78 ALDH1A1 (0.46) ALDH1A1TP53CYP3A4
SCHEMBL27937398 0.78 ALDH1A1 (0.38) ALDH1A1TP53CYP3A4
SCHEMBL27830953 0.78 ALDH1A1 (0.42) ALDH1A1TP53CYP3A4
Ammonia Solution, Strong SCHEMBL28108517 0.78 ALDH1A1 (0.46) ALDH1A1TP53CYP3A4
SCHEMBL9845225 0.78 ALDH1A1 (0.42) ALDH1A1TP53CYP3A4
Methyl Alcohol SCHEMBL29284825 0.78 ALDH1A1 (0.46) ALDH1A1TP53CYP3A4
Ethane SCHEMBL27650604 0.78 ALDH1A1 (0.46) ALDH1A1TP53CYP3A4

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
CN-118005827-A Photopolymerization initiator 科巨希化学股份有限公司 2024-05-10 CN disclosed
CN-114929757-A Photopolymerization initiator 科巨希化学股份有限公司 2022-08-19 CN disclosed