SCHEMBL28107693

SCHEMBL28107693

C=CC(=O)OCCC[SiH2]OCC.CCO[SiH2]OCC

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.54
HPGD P15428 1/20 0.54
ALDH1A1 P00352 4/20 0.50
CYP3A4 P08684 2/20 0.50
TP53 P04637 3/20 0.42
HIF1A Q16665 3/20 0.42
HSD17B10 Q99714 1/20 0.42
THRB P10828 2/20 0.40
ATM Q13315 1/20 0.37
HCAR2 Q8TDS4 3/20 0.33
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL1015223 0.95 TSHR (0.59) TSHRHPGDALDH1A1CYP3A4TP53
Phosphine SCHEMBL28175773 0.94 TSHR (0.58) TSHRHPGDALDH1A1CYP3A4TP53
Propene SCHEMBL28137991 0.92 TSHR (0.56) TSHRHPGDALDH1A1CYP3A4TP53
Hydrochloric Acid SCHEMBL28159246 0.92 TSHR (0.56) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL28110497 0.91 TSHR (0.51) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL28029882 0.91 TSHR (0.54) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL28119923 0.91 TSHR (0.54) TSHRHPGDALDH1A1CYP3A4TP53
Trimethylammonium SCHEMBL28223811 0.91 TSHR (0.54) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL28174477 0.91 TSHR (0.54) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL27999143 0.91 TSHR (0.54) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105579537-B Adhesive composite 东亚合成株式会社 2018-11-27 CN disclosed
CN-106094061-B Optical film and its manufacturing method 柯尼卡美能达株式会社 2018-09-07 CN disclosed
CN-106433323-A Rainbow aluminum paste and preparation method thereof 安徽天易金属新材料有限公司 2017-02-22 CN disclosed
CN-106094061-A Blooming and manufacture method thereof 柯尼卡美能达株式会社 2016-11-09 CN disclosed