SCHEMBL29878679

SCHEMBL29878679

CC(C)OCCN1c2ccn(COC(=O)CCCCCCC(=O)OCn3ccc4c3C(=O)NC(S(=O)(=O)O)N4CCOC(C)C)c2C(=O)NC1S(=O)(=O)O

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ EP300 Q09472 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
SCHEMBL28849738 0.71 OPRM1 (0.37) —
SCHEMBL29879210 0.71 OPRM1 (0.37) —
SCHEMBL29211250 0.68 — —
SCHEMBL29879712 0.66 — —
SCHEMBL29211252 0.62 OPRM1 (0.31) —
SCHEMBL755078 0.54 DGKA (0.50) —
SCHEMBL3656150 0.53 DGKA (0.75) —
SCHEMBL3655660 0.53 DGKA (0.75) —
SCHEMBL3661199 0.53 DGKA (0.75) —
SCHEMBL17148353 0.53 DGKA (0.53) —

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-114945573-A Prodrugs of myeloperoxidase inhibitors 拜奥海芬治疗学有限公司 2022-08-26 — — CN disclosed
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