SCHEMBL9764401

SCHEMBL9764401

C=CC(=O)OCCC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)O[Si](C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.50
ALDH1A1 P00352 4/20 0.50
CYP3A4 P08684 2/20 0.50
HPGD P15428 1/20 0.50
TP53 P04637 3/20 0.42
HIF1A Q16665 3/20 0.42
HSD17B10 Q99714 1/20 0.42
THRB P10828 2/20 0.36
ATM Q13315 1/20 0.33
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HCAR2 Q8TDS4 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
SCHEMBL344379 0.94 TSHR (0.57) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL9301778 0.89 TSHR (0.60) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL15215482 0.86 TSHR (0.52) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL9764152 0.86 TSHR (0.52) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL9973557 0.85 TSHR (0.37) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL9763730 0.84 TSHR (0.50) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL10661647 0.84 TSHR (0.50) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL10888473 0.84 TSHR (0.59) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL4883019 0.84 TSHR (0.46) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL397193 0.83 TSHR (0.50) TSHRALDH1A1CYP3A4HPGDTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4988788-A Room temperature-curable coating composition SHIN-ETSU CHEMICAL CO., LTD. (JP) 1991-01-29 US claimed
US-20180006285-A1 SEPARATOR FOR LITHIUM SECONDARY BATTERY, AND LITHIUM SECONDARY BATTERY COMPRISING SAME SAMSUNG SDI CO., LTD. (KR) 2018-01-04 US disclosed
US-20160293920-A1 SEPARATOR FOR RECHARGEABLE LITHIUM BATTERY AND RECHARGEABLE LITHIUM BATTERY INCLUDING THE SAME SAMSUNG SDI CO., LTD. (KR) 2016-10-06 US disclosed
US-20150322366-A1 Lubricant Coating for Medical Container BECTON DICKINSON FRANCE (FR) 2015-11-12 US disclosed