SCHEMBL5701336

SCHEMBL5701336

C=CC(=O)OCCCC(O[SiH3])(O[Si](C)(C)C=C)O[Si](C)(C)C=C

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.45
HPGD P15428 1/20 0.45
ALDH1A1 P00352 4/20 0.45
CYP3A4 P08684 2/20 0.45
TP53 P04637 3/20 0.38
HIF1A Q16665 3/20 0.38
HSD17B10 Q99714 1/20 0.38
THRB P10828 2/20 0.36
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
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
SCHEMBL393549 0.90 TSHR (0.49) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL5701676 0.88 ATM (0.34) TSHRHPGDALDH1A1CYP3A4ATM
SCHEMBL5701929 0.87 TSHR (0.53) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL5701878 0.86 TSHR (0.49) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL6309352 0.84 TSHR (0.49) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL5701481 0.83 TSHR (0.49) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL5701744 0.81 TSHR (0.43) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL20555650 0.78 TSHR (0.53) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL394437 0.78 TSHR (0.52) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL5701983 0.77 TSHR (0.47) 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
EP-1510520-B1 Preparation of branched siloxane SHINETSU CHEMICAL CO (JP) 2006-07-26 EP disclosed
US-6943264-B2 Preparation of branched siloxane SHIN-ETSU CHEMICAL, CO., LTD. (JP) 2005-09-13 US disclosed
US-20050049427-A1 Preparation of branched siloxane SHIN-ETSU CHEMICAL CO., LTD. (JP) 2005-03-03 US disclosed
EP-1510520-A1 Preparation of branched siloxane Shin-Etsu Chemical Co., Ltd. (JP) 2005-03-02 EP disclosed