SCHEMBL7914967

SCHEMBL7914967

CC(c1cccc(OC#N)c1)[Si](Cl)(Cl)Cl

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.35
PTGS1 P23219 1/20 0.34
MEN1 O00255 1/20 0.34
CYP2D6 P10635 1/20 0.34
KMT2A Q03164 1/20 0.34
BCHE P06276 2/20 0.33
ALOX5 P09917 1/20 0.33
AOC3 Q16853 2/20 0.33
PFKFB3 Q16875 2/20 0.32
FAAH O00519 1/20 0.32
KDM4E B2RXH2 1/20 0.32
TSHR P16473 1/20 0.32
CASR P41180 3/20 0.31
SGMS2 Q8NHU3 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
SCHEMBL7906843 0.82 ACHE (0.34) ACHEPTGS1MEN1CYP2D6KMT2A
SCHEMBL7915046 0.81 AOC3 (0.33) ACHEBCHEAOC3PFKFB3FAAH
SCHEMBL7913947 0.81 ALDH1A1 (0.34)
SCHEMBL7917060 0.78 KDM4E (0.35) ACHEPTGS1MEN1CYP2D6KMT2A
SCHEMBL7914532 0.75 TAAR1 (0.43) ACHE
SCHEMBL26009 0.73 KMT2A (0.41) ACHEMEN1CYP2D6KMT2ATSHR
SCHEMBL27546366 0.72 KDM4E (0.40) PTGS1MEN1CYP2D6KMT2AALOX5
SCHEMBL7915126 0.71 AOC3 (0.34) ACHEBCHEAOC3PFKFB3FAAH
SCHEMBL5491149 0.71 ACHE (0.44) ACHEAOC3PFKFB3TSHR
SCHEMBL5491029 0.71 AOC3 (0.44) AOC3CASR

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