SCHEMBL7914933

SCHEMBL7914933

CO[Si](CCCc1ccccc1OC#N)(OC)OC

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.40
MTNR1A P48039 1/20 0.37
MTNR1B P49286 1/20 0.37
MPO P05164 1/20 0.37
SIGMAR1 Q99720 1/20 0.36
AOC3 Q16853 1/20 0.36
KCNH2 Q12809 1/20 0.36
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35
ALOX5 P09917 1/20 0.35
PTGS2 P35354 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
ABCB1 P08183 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
SCHEMBL7906930 0.91 TAAR1 (0.42) TAAR1MTNR1AMTNR1BSIGMAR1AOC3
SCHEMBL7913941 0.85 THRA (0.32) TAAR1MTNR1AMTNR1BMPOALOX5
SCHEMBL2530005 0.82 TAAR1 (0.33) TAAR1MTNR1AMTNR1BMPOSIGMAR1
SCHEMBL7916831 0.81 TAAR1 (0.32) TAAR1MPO
SCHEMBL1639308 0.80 MTNR1A (0.40) TAAR1MTNR1AMTNR1BMPOSIGMAR1
SCHEMBL27716415 0.79 THRA (0.43) TAAR1ALOX5PTGS2
SCHEMBL27668716 0.78 HTR1A (0.42) TAAR1SIGMAR1AOC3KCNH2CYP11B1
SCHEMBL29038956 0.76 THRA (0.51) ALOX5PTGS2
SCHEMBL8848687 0.76 THRA (0.51) ALOX5PTGS2
SCHEMBL7906863 0.76 TAAR1 (0.33) TAAR1MTNR1AMTNR1BSIGMAR1AOC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6217943-B1 ADHESION AND REINFORCEMENT WITH SILANE CYANATE COUPLERS 3M INNOVATIVE PROPERTIES COMPANY 2001-04-17 US disclosed
US-5912377-A CONTAINING AT LEAST ONE CYANATE ESTER GROUP AND HYDROLYZABLE SILYL GROUP; REINFORCED COMPOSITES, ADESIVES, COATINGS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1999-06-15 US disclosed
EP-0830410-B1 AROMATIC CYANATE ESTER SILANE COUPLING AGENTS MINNESOTA MINING & MFG (US) 1999-04-07 EP disclosed
EP-0830410-A1 AROMATIC CYANATE ESTER SILANE COUPLING AGENTS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1998-03-25 EP disclosed
WO-1996039457-A1 AROMATIC CYANATE ESTER SILANE COUPLING AGENTS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-12-12 WO disclosed