SCHEMBL28814535

SCHEMBL28814535

C=CC(=O)OCCO[Si](CCCCCCCCCCCCCC)(OCC)OCC

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 10/20 0.54
HPGD P15428 1/20 0.54
ALDH1A1 P00352 3/20 0.46
CYP3A4 P08684 1/20 0.46
TP53 P04637 2/20 0.42
HIF1A Q16665 2/20 0.42
HSD17B10 Q99714 1/20 0.42
THRB P10828 4/20 0.40
HCAR2 Q8TDS4 3/20 0.39
ATM Q13315 1/20 0.38
THRA P10827 1/20 0.37
ZDHHC20 Q5W0Z9 1/20 0.37
ZDHHC2 Q9UIJ5 1/20 0.37
DGKA P23743 1/20 0.37

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
SCHEMBL27985544 1.00 TSHR (0.54) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL27699553 1.00 TSHR (0.54) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL27985884 1.00 TSHR (0.54) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL27795147 1.00 TSHR (0.54) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL27985547 1.00 TSHR (0.54) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL27743782 1.00 TSHR (0.54) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL27680759 1.00 TSHR (0.54) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL27699554 1.00 TSHR (0.54) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL27764597 0.99 TSHR (0.56) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL10601643 0.88 TSHR (0.61) TSHRHPGDALDH1A1CYP3A4TP53

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-104140733-A Low-temperature cureable coating composition and article having cured coating thereof SHINETSU CHEMICAL CO 2014-11-12 CN disclosed