SCHEMBL5701781

SCHEMBL5701781

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

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.47
THRB P10828 1/20 0.45
POLB P06746 1/20 0.38
APEX1 P27695 1/20 0.38
HTT P42858 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ALDH1A1 P00352 2/20 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
SCHEMBL247231 0.90 TSHR (0.50) TSHRTHRBPOLBAPEX1HTT
SCHEMBL21811060 0.88 TSHR (0.49) TSHRTHRBPOLBAPEX1HTT
SCHEMBL37108 0.88 TSHR (0.56) TSHRTHRBPOLBAPEX1HTT
SCHEMBL25235967 0.88 TSHR (0.56) TSHRTHRBPOLBAPEX1HTT
Hydrogen Sulfide SCHEMBL329936 0.86 TSHR (0.54) TSHRTHRBPOLBAPEX1HTT
Methyl Alcohol SCHEMBL28830046 0.86 TSHR (0.54) TSHRTHRBPOLBAPEX1HTT
SCHEMBL14060478 0.86 TSHR (0.54) TSHRTHRBPOLBAPEX1HTT
SCHEMBL5701761 0.85 TSHR (0.46) TSHRTHRBPOLBAPEX1HTT
Alcohol SCHEMBL4941627 0.85 TSHR (0.53) TSHRTHRBPOLBAPEX1HTT
SCHEMBL222521 0.84 TSHR (0.51) TSHRTHRBPOLBAPEX1HTT

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