SCHEMBL7915129

SCHEMBL7915129

CCOc1cc(C(CC)[Si](OCC)(OCC)OCC)ccc1OC#N

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.40
PDE4B Q07343 8/20 0.39
PDE4A P27815 7/20 0.39
PDE4C Q08493 7/20 0.39
PDE4D Q08499 7/20 0.39
SMN1; SMN2 Q16637 5/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
LMNA P02545 3/20 0.35
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
HPGD P15428 2/20 0.33
HSD17B10 Q99714 2/20 0.33
USP2 O75604 1/20 0.33
PRNP P04156 1/20 0.33
MAPT P10636 1/20 0.33
ALOX15 P16050 1/20 0.33
BRCA1 P38398 1/20 0.33
S1PR1 P21453 2/20 0.32

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) ALDH1A1PDE4BPDE4APDE4CPDE4D
SCHEMBL7906859 0.89 ALDH1A1 (0.43) ALDH1A1PDE4BPDE4APDE4CPDE4D
SCHEMBL7920309 0.85 ALDH1A1 (0.43) ALDH1A1PDE4BPDE4APDE4CPDE4D
SCHEMBL7915016 0.79 PBRM1 (0.31)
SCHEMBL7916756 0.78 PDE4A (0.39) ALDH1A1PDE4BPDE4APDE4CPDE4D
SCHEMBL7916844 0.77 ALDH1A1 (0.33) ALDH1A1MEN1KMT2AKDM4E
SCHEMBL7906900 0.76 ALDH1A1 (0.34) ALDH1A1PDE4BPDE4APDE4CPDE4D
SCHEMBL7915021 0.76 ADRA2A (0.32) ALDH1A1SMN1; SMN2L3MBTL1MEN1KMT2A
SCHEMBL17442491 0.74 LMNA (0.32) LMNAMAPTALOX15
SCHEMBL7916822 0.72 ACHE (0.42) ALDH1A1PDE4BPDE4APDE4CPDE4D

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