SCHEMBL28465283

SCHEMBL28465283

C=CC(=O)OCCOC(C)[Si](OCC)(OCC)OCC

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.46
HPGD P15428 1/20 0.46
ALDH1A1 P00352 4/20 0.46
TP53 P04637 3/20 0.46
HIF1A Q16665 3/20 0.46
HSD17B10 Q99714 1/20 0.46
THRB P10828 3/20 0.43
CYP3A4 P08684 2/20 0.42
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ATM Q13315 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
SCHEMBL970918 0.83 TSHR (0.45) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL28019893 0.81 TSHR (0.49) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL2476564 0.78 TSHR (0.41) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL472194 0.77 TSHR (0.52) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL273269 0.76 TSHR (0.55) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL1171239 0.76 TSHR (0.59) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL32689960 0.76 TSHR (0.59) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL3821048 0.75 TSHR (0.53) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL2133150 0.75 TSHR (0.53) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL18419982 0.74 TSHR (0.57) TSHRHPGDALDH1A1TP53HIF1A

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-111676596-A Latex bonded textile fiber structures for architectural applications 德国昕特玛有限公司 2020-09-18 CN disclosed