SCHEMBL236553

SCHEMBL236553

C=CC(=O)OCC(C)C(C)(C)O[SiH3]

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.56
ALDH1A1 P00352 4/20 0.38
TP53 P04637 3/20 0.38
HIF1A Q16665 3/20 0.38
CYP3A4 P08684 2/20 0.38
MAPK1 P28482 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.37
THRB P10828 1/20 0.36

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
SCHEMBL13268647 0.82 TSHR (0.64) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL3440907 0.81 TSHR (0.49) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL27947863 0.79 TSHR (0.60) TSHRALDH1A1TP53HIF1ACYP3A4
Water SCHEMBL31298579 0.77 TSHR (0.58) TSHRALDH1A1TP53HIF1ACYP3A4
Bromide SCHEMBL2991497 0.77 TSHR (0.58) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL23493932 0.77 TSHR (0.58) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL20015418 0.77 TSHR (0.62) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL17858340 0.76 TSHR (0.49) TSHRALDH1A1TP53HIF1ACYP3A4
Acetic Acid SCHEMBL2993587 0.75 TSHR (0.55) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL20787717 0.74 TSHR (0.58) TSHRALDH1A1TP53HIF1ACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240279441-A1 RUBBER COMPOSITION AND TIRE BRIDGESTONE CORPORATION (JP) 2024-08-22 US disclosed
EP-4349902-A1 RUBBER COMPOSITION AND TIRE BRIDGESTONE CORPORATION (JP) 2024-04-10 EP disclosed
US-11530318-B2 Rubber composition and pneumatic tire BRIDGESTONE CORPORATION (JP) 2022-12-20 US disclosed
WO-2022254751-A1 RUBBER COMPOSITION AND TIRE 株式会社ブリヂストン 2022-12-08 WO disclosed
EP-3725836-B1 RUBBER COMPOSITION AND PNEUMATIC TIRE BRIDGESTONE CORP (JP) 2022-08-24 EP disclosed
US-9745406-B2 Curable composition CEMEDINE CO., LTD. (JP) 2017-08-29 US disclosed
EP-2412756-B1 CURABLE COMPOSITION CEMEDINE CO LTD (JP) 2016-12-21 EP disclosed
EP-2412756-A1 CURABLE COMPOSITION CEMEDINE CO., LTD. (JP) 2012-02-01 EP disclosed
US-20120004371-A1 CURABLE COMPOSITION CEMEDINE CO., LTD. (JP) 2012-01-05 US disclosed