SCHEMBL7917060

SCHEMBL7917060

CCO[Si](OCC)(OCC)C(C)c1cccc(OC#N)c1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.35
TSHR P16473 1/20 0.35
ACHE P22303 3/20 0.35
BCHE P06276 2/20 0.35
FAAH O00519 1/20 0.35
ALDH1A1 P00352 2/20 0.34
AOC3 Q16853 1/20 0.32
CASR P41180 3/20 0.32
MEN1 O00255 1/20 0.31
CYP2D6 P10635 1/20 0.31
KMT2A Q03164 1/20 0.31
PTGS1 P23219 1/20 0.31
MARK4 Q96L34 1/20 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
SCHEMBL7916844 0.86 ALDH1A1 (0.33) KDM4ETSHRACHEBCHEFAAH
SCHEMBL7906938 0.83 PBRM1 (0.32)
SCHEMBL7906843 0.83 ACHE (0.34) KDM4ETSHRACHEBCHEFAAH
SCHEMBL574687 0.81 HDAC4 (0.33) KDM4ETSHRACHEBCHEFAAH
SCHEMBL8603014 0.79 TAAR1 (0.40) ACHE
SCHEMBL7914967 0.78 ACHE (0.35) KDM4ETSHRACHEBCHEFAAH
SCHEMBL7915126 0.75 AOC3 (0.34) KDM4ETSHRACHEBCHEFAAH
SCHEMBL7915046 0.73 AOC3 (0.33) KDM4ETSHRACHEBCHEFAAH
SCHEMBL574617 0.73 TAAR1 (0.39) ALDH1A1AOC3
SCHEMBL21924088 0.73 SLC6A3 (0.33) CYP2D6

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