SCHEMBL7916756

SCHEMBL7916756

CCC(c1ccc(OC#N)c(OC)c1)[Si](OC)(OC)OC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 2/20 0.39
PDE4B Q07343 2/20 0.39
PDE4C Q08493 2/20 0.39
PDE4D Q08499 2/20 0.39
ACHE P22303 3/20 0.39
ATM Q13315 1/20 0.39
ALDH1A1 P00352 9/20 0.38
TSHR P16473 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
HTT P42858 2/20 0.37
PPARG P37231 1/20 0.37
PPARD Q03181 1/20 0.37
PPARA Q07869 1/20 0.37
CYP1A2 P05177 1/20 0.35
LMNA P02545 3/20 0.35
MAPT P10636 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL7913939 0.89 ALDH1A1 (0.39) PDE4APDE4BPDE4CPDE4DACHE
SCHEMBL7906859 0.89 ALDH1A1 (0.43) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7916822 0.86 ACHE (0.42) PDE4APDE4BPDE4CPDE4DACHE
SCHEMBL7916771 0.79 PBRM1 (0.35) ALDH1A1LMNA
SCHEMBL7915129 0.78 ALDH1A1 (0.40) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7915126 0.77 AOC3 (0.34) ACHEALDH1A1TSHRL3MBTL1KDM4E
SCHEMBL29168558 0.76 TSHR (0.49) ACHETSHRRAB9ASMN1; SMN2LMNA
SCHEMBL17442501 0.74 CYP17A1 (0.34) CYP1A2LMNAMAPT
SCHEMBL7916891 0.74 TSHR (0.32) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7920309 0.73 ALDH1A1 (0.43) PDE4APDE4BPDE4CPDE4DALDH1A1

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