SCHEMBL28289488

SCHEMBL28289488

C=CC(=O)OC(CCC)[Si](OC)(OC)OC.[SiH4]

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.37
HPGD P15428 1/20 0.37
THRB P10828 1/20 0.32
ALDH1A1 P00352 1/20 0.30
TP53 P04637 1/20 0.30
CYP3A4 P08684 1/20 0.30
MAPK1 P28482 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HIF1A Q16665 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
SCHEMBL3905874 0.98 TSHR (0.38) TSHRHPGDTHRBALDH1A1TP53
Ether SCHEMBL28140989 0.92 TSHR (0.35) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL28232930 0.91 TSHR (0.34) TSHRHPGD
Methacrylic Acid SCHEMBL28223869 0.90 TSHR (0.33) TSHRHPGD
SCHEMBL9947745 0.89 TSHR (0.46) TSHRHPGDTHRBALDH1A1CYP3A4
SCHEMBL9947807 0.87 TSHR (0.42) TSHRHPGDTHRB
SCHEMBL139016 0.86 TSHR (0.36) TSHRHPGDTHRBALDH1A1TP53
SCHEMBL28894229 0.86 TSHR (0.41) TSHRHPGDTHRBALDH1A1CYP3A4
SCHEMBL20336761 0.86 TSHR (0.41) TSHRHPGDTHRBALDH1A1CYP3A4
SCHEMBL1974554 0.86 TSHR (0.41) TSHRHPGDTHRBALDH1A1CYP3A4

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-110461589-A Polymeric substrate with hard conating TEIJIN LTD 2019-11-15 CN disclosed
CN-105623500-B The weatherability coating composition of normal temperature cure 关西涂料株式会社 2019-10-11 CN disclosed
CN-109714965-A Plant liquid spraying agent 日本合成化学工业株式会社 2019-05-03 CN disclosed