SCHEMBL9488658

SCHEMBL9488658

C=Cc1ccc([Si](C)(C)F)cc1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.52
TDP1 Q9NUW8 2/20 0.40
TSHR P16473 1/20 0.40
HDAC8 Q9BY41 3/20 0.39
NR1H2 P55055 2/20 0.33
NR1H3 Q13133 2/20 0.33
TP53 P04637 1/20 0.32
CHRNB2 P17787 1/20 0.32
CHRNB4 P30926 1/20 0.32
CHRNA3 P32297 1/20 0.32
CHRNA7 P36544 1/20 0.32
CHRNA4 P43681 1/20 0.32
TRPA1 O75762 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
SCHEMBL141101 0.80 ALDH1A1 (0.58) ALDH1A1TDP1TSHRHDAC8NR1H2
SCHEMBL7649599 0.80 ALDH1A1 (0.58) ALDH1A1TDP1TSHRHDAC8NR1H2
SCHEMBL704855 0.79 NR1H2 (0.35) NR1H2NR1H3
SCHEMBL4601562 0.76 ALDH1A1 (0.52) ALDH1A1TDP1TSHRHDAC8TP53
SCHEMBL30991325 0.76 ALDH1A1 (0.52) ALDH1A1TDP1TSHRHDAC8TP53
SCHEMBL30423535 0.76 ALDH1A1 (0.52) ALDH1A1TDP1TSHRHDAC8NR1H2
SCHEMBL899595 0.76 ALDH1A1 (0.52) ALDH1A1TDP1TSHRHDAC8TP53
SCHEMBL7869586 0.76 ALDH1A1 (0.52) ALDH1A1TDP1TSHRHDAC8TP53
SCHEMBL15473032 0.76 ALDH1A1 (0.52) ALDH1A1TDP1TSHRHDAC8NR1H2
SCHEMBL8758099 0.76 ALDH1A1 (0.52) ALDH1A1TDP1TSHRHDAC8NR1H2

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5210143-A Block polymer of nonelastic vinyl aromatic segments. elastic diene segments and a vinyl aromatic compound having halo- or oxysilyl groups or metal halide or oxymetal groups; pressure sensitive adhesives MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1993-05-11 US disclosed
US-5115034-A Branching polymers with organometallic styrene derivative, a hydrocarbyl lithium initiator and a monomer MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1992-05-19 US disclosed
US-5079090-A Pressure sensitive adhesives MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1992-01-07 US disclosed
US-4996266-A Branched elastomeric and block copolymers MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1991-02-26 US disclosed
US-4906691-A Adhesive compositions made with condensed phase polymers and sheet materials coated therewith MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1990-03-06 US disclosed
US-4857618-A ELASTOMERIC, ANIONIC COPOLYMERS; ORGANOMETALLIC CONDENSING AGENT; PRESSURE SENSITIVE ADHESIVES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1989-08-15 US disclosed
US-4857615-A Method of making condensed phase polymers MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1989-08-15 US disclosed