SCHEMBL28136239

SCHEMBL28136239

C=CC(=O)OCCC[SiH](C)C(OCC)OCC

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.53
HPGD P15428 1/20 0.53
ALDH1A1 P00352 4/20 0.49
CYP3A4 P08684 2/20 0.49
TP53 P04637 3/20 0.41
HIF1A Q16665 3/20 0.41
HSD17B10 Q99714 1/20 0.41
THRB P10828 2/20 0.39
ATM Q13315 1/20 0.36
HCAR2 Q8TDS4 3/20 0.33
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL28036957 0.91 TSHR (0.47) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL28074171 0.84 TSHR (0.52) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL28101516 0.81 TSHR (0.43) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL27670300 0.79 TSHR (0.50) TSHRALDH1A1THRB
SCHEMBL1585542 0.77 TSHR (0.63) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL3338971 0.76 TSHR (0.58) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL16537688 0.75 TSHR (0.53) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL8326378 0.75 TSHR (0.61) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL501946 0.75 TSHR (0.61) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL28175772 0.75 TSHR (0.56) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106519235-B Polysiloxane series crosslinking agent utilizes ethylene base system graft copolymer powder and preparation method thereof made from the crosslinking agent 广州熵能创新材料股份有限公司 2019-09-06 CN claimed
CN-106519235-A Polysiloxane crosslinking agent, vinyl grafted copolymer powder prepared by using crosslinking agent and preparation method of vinyl grafted copolymer powder 广州熵能创新材料股份有限公司 2017-03-22 CN claimed