SCHEMBL5701614

SCHEMBL5701614

C=Cc1cccc([Si](O[Si](CC)(CC)CC)(O[Si](CC)(CC)CC)O[Si](CC)(CC)CC)c1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
TRPA1 O75762 1/20 0.30
PARP1 P09874 1/20 0.30
PTGS2 P35354 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
SCHEMBL5701639 0.81 TP53 (0.46) TP53TDP1ALDH1A1TSHRTRPA1
SCHEMBL29434674 0.80 TP53 (0.44) TP53TDP1ALDH1A1TSHRTRPA1
SCHEMBL437296 0.80 TP53 (0.44) TP53TDP1ALDH1A1TSHRTRPA1
SCHEMBL5701945 0.80 ALDH1A1 (0.41) TDP1ALDH1A1TSHRTRPA1
SCHEMBL2357767 0.79 TP53 (0.50) TP53TDP1ALDH1A1TSHRTRPA1
SCHEMBL5701828 0.79 TP53 (0.43) TP53TDP1ALDH1A1TSHRTRPA1
SCHEMBL435537 0.78 TP53 (0.48) TP53TDP1ALDH1A1TSHRTRPA1
SCHEMBL29434664 0.78 TP53 (0.48) TP53TDP1ALDH1A1TSHRTRPA1
SCHEMBL29434608 0.77 TP53 (0.42) TP53TDP1ALDH1A1TSHRTRPA1
SCHEMBL5701495 0.77 TP53 (0.42) TP53TDP1ALDH1A1TSHRTRPA1

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