SCHEMBL4450163

SCHEMBL4450163

CCCCO[Si](N=C=O)(N=C=O)N=C=O

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.33
ALDH1A1 P00352 1/20 0.32
ADRB2 P07550 1/20 0.32
ADRB1 P08588 1/20 0.32
ADRB3 P13945 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
ATM Q13315 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
SCHEMBL9185382 0.83 CYP3A4 (0.33) CYP3A4ALDH1A1ADRB2ADRB1ADRB3
SCHEMBL557923 0.78 CYP3A4 (0.30) CYP3A4
SCHEMBL1046163 0.77
SCHEMBL556672 0.72 CA1 (0.31) CA1CA2
SCHEMBL17272686 0.71 CYP3A4 (0.31) CYP3A4ALDH1A1ADRB2ADRB1ADRB3
SCHEMBL28059507 0.69 CYP3A4 (0.30) CYP3A4
SCHEMBL575766 0.68
SCHEMBL728497 0.67 NAAA (0.31)
SCHEMBL556632 0.67
SCHEMBL17799322 0.67 CA1 (0.37) CYP3A4ALDH1A1ADRB2ADRB1ADRB3

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-11130885-A None JP disclosed
US-20090008885-A1 Waterproof Gasket NOK CORPORATION (JP) 2009-01-08 US disclosed
EP-1998087-A1 WATERPROOF GASKET NOK Corporation (JP) 2008-12-03 EP disclosed
JP-H11130885-A BAG FOR TIRE AND ITS PRODUCTION, AND METALLIC TIMBER AND ITS PRODUCTION SHINKO GIKEN KK 1999-05-18 JP disclosed
US-5037447-A Method for producing laundry-resistant recording medium KANZAKI PAPER MANUFACTURING COMPANY, LIMITED (JP) 1991-08-06 US disclosed
EP-0326961-A2 Method for producing laundry-resistant recorded medium KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1989-08-09 EP disclosed
US-4766037-A Photodegradable microcapsules FUJI PHOTO FILM CO., LTD. (JP) 1988-08-23 US disclosed
US-4433127-A SILYL ISOCYANATE, ORGANO-TITANIUM-OXYGEN-PHOSPHORUS COMPOUND MATSUMOTO SEIYAKU KOGYO KABUSHIKI KAISHA (JP) 1984-02-21 US disclosed