SCHEMBL28651253

SCHEMBL28651253

CCOP(=O)(OCC)OC(O)CC

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.52
TP53 P04637 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
PPARD Q03181 2/20 0.37
POLB P06746 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.35
GAA P10253 1/20 0.33
CYP3A4 P08684 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
SCHEMBL29580 0.85 TSHR (0.48) TSHRL3MBTL1CYP3A4
SCHEMBL1992049 0.81 TSHR (0.43) TSHR
SCHEMBL212641 0.79 TSHR (0.44) TSHRL3MBTL1CYP3A4
SCHEMBL28740107 0.79 CYP3A4 (0.59) TSHRL3MBTL1GAACYP3A4
SCHEMBL28012460 0.79 TSHR (0.42) TSHRCYP3A4
SCHEMBL9749945 0.79 TSHR (0.55) TSHRTP53TDP1PPARDPOLB
SCHEMBL5354926 0.75 CYP3A4 (0.59) TSHRL3MBTL1GAACYP3A4
SCHEMBL5908843 0.74 TSHR (0.55) TSHRTP53TDP1PPARDPOLB
SCHEMBL29582 0.73
SCHEMBL7152553 0.73 TSHR (0.46) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113150662-B PAE polyurea foaming flame-retardant heat-preservation high-strength coating 浙江艾特普科技有限公司 2022-02-18 CN claimed
CN-113354682-A Halogen-free flame-retardant polyaspartic acid ester and preparation method and application thereof 姜山 2021-09-07 CN claimed
CN-113150662-A PAE polyurea foaming flame-retardant heat-preservation high-strength coating 浙江艾特普科技有限公司 2021-07-23 CN claimed
CN-113150662-B PAE polyurea foaming flame-retardant heat-preservation high-strength coating 浙江艾特普科技有限公司 2022-02-18 CN disclosed
CN-113354682-A Halogen-free flame-retardant polyaspartic acid ester and preparation method and application thereof 姜山 2021-09-07 CN disclosed
CN-113150662-A PAE polyurea foaming flame-retardant heat-preservation high-strength coating 浙江艾特普科技有限公司 2021-07-23 CN disclosed