SCHEMBL7916894

SCHEMBL7916894

CO[Si](OC)(OC)C(C)c1ccc(OC#N)cc1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PBRM1 Q86U86 1/20 0.34
ALDH1A1 P00352 7/20 0.33
GAA P10253 3/20 0.33
LMNA P02545 2/20 0.32
HTT P42858 1/20 0.31
ESR1 P03372 1/20 0.30
ESR2 Q92731 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
SCHEMBL7906938 0.81 PBRM1 (0.32) PBRM1ESR1ESR2
SCHEMBL7906843 0.81 ACHE (0.34) PBRM1
SCHEMBL235152 0.80 ESR1 (0.36) ALDH1A1ESR1ESR2
SCHEMBL7913947 0.80 ALDH1A1 (0.34) ALDH1A1GAALMNAESR1ESR2
SCHEMBL7916771 0.78 PBRM1 (0.35) PBRM1ALDH1A1GAALMNAESR1
SCHEMBL27657818 0.77 MEN1 (0.38) ALDH1A1GAAHTT
SCHEMBL29913553 0.77 ESR1 (0.39) PBRM1ALDH1A1GAALMNAESR1
SCHEMBL139926 0.77 ESR1 (0.41) PBRM1ALDH1A1GAALMNAESR1
SCHEMBL31166667 0.75 ESR1 (0.39) PBRM1ALDH1A1GAAESR1ESR2
SCHEMBL7917112 0.75 SLC6A4 (0.39)

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