SCHEMBL2744216

SCHEMBL2744216

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

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.40
ALDH1A1 P00352 1/20 0.34
THRB P10828 1/20 0.34

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
SCHEMBL2744046 0.90 TSHR (0.36) TSHRALDH1A1THRB
SCHEMBL2744772 0.86 TSHR (0.38) TSHRALDH1A1THRB
SCHEMBL2744716 0.86 TSHR (0.33) TSHR
SCHEMBL2744406 0.86 TSHR (0.33) TSHR
SCHEMBL2744837 0.79 TSHR (0.39) TSHRALDH1A1
SCHEMBL2744855 0.79 TSHR (0.39) TSHRALDH1A1
SCHEMBL2744752 0.78 TSHR (0.34) TSHRALDH1A1
SCHEMBL2743688 0.77 TSHR (0.39) TSHR
SCHEMBL10613414 0.77 ALDH1A1 (0.39) TSHRALDH1A1THRB
SCHEMBL3298710 0.76 TSHR (0.37) TSHRALDH1A1

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
US-8178710-B2 Silyl (meth)acrylate compound containing a siloxy group having a bulky substituent and its production method SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-05-15 US disclosed
US-20100105938-A1 SILYL (METH)ACRYLATE COMPOUND CONTAINING A SILOXY GROUP HAVING A BULKY SUBSTITUENT AND ITS PRODUCTION METHOD SHIN-ETSU CHEMICAL CO., LTD. (JP) 2010-04-29 US disclosed