SCHEMBL28626537

SCHEMBL28626537

CCOP(=O)(OCC)N(C(C)(C)C)C(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
TSHR P16473 2/20 0.43
ACHE P22303 1/20 0.35
PPARD Q03181 2/20 0.34
AOX1 Q06278 1/20 0.32
HMGCR P04035 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
SCHEMBL9791411 0.70 TSHR (0.50) TP53TDP1TSHRACHEPPARD
SCHEMBL27811962 0.69 ACHE (0.48) TP53TDP1TSHRACHEPPARD
SCHEMBL3289373 0.69 TSHR (0.48) TP53TDP1TSHRACHEPPARD
SCHEMBL29597934 0.67 TSHR (0.46) TP53TDP1TSHRACHEPPARD
SCHEMBL10308658 0.67 TSHR (0.46) TP53TDP1TSHRACHEPPARD
SCHEMBL23005901 0.65 PPARD (0.40) TP53TDP1TSHRACHEPPARD
SCHEMBL575839 0.65 TSHR (0.50) TP53TDP1TSHRACHEPPARD
SCHEMBL13657439 0.65 TSHR (0.50) TP53TDP1TSHRACHEPPARD
SCHEMBL9115350 0.65 TSHR (0.50) TP53TDP1TSHRACHEPPARD
SCHEMBL12207660 0.65 TSHR (0.43) TP53TDP1TSHRACHEPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116283647-A Prodrug modulators that integrate stress pathways 卡里科生命科学有限责任公司 2023-06-23 CN disclosed
CN-113423685-B Prodrug modulators of integrated stress pathways 卡里科生命科学有限责任公司 2022-11-29 CN disclosed
CN-113423685-A Prodrug modulators of integrated stress pathways 卡里科生命科学有限责任公司 2021-09-21 CN disclosed