SCHEMBL820793

SCHEMBL820793

COC([SiH3])(OC)c1ccccc1N

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
TDP1 Q9NUW8 3/20 0.41
ADRA2B P18089 1/20 0.41
PTGS1 P23219 1/20 0.41
CYP3A4 P08684 3/20 0.38
ALOX15 P16050 2/20 0.38
CASP1 P29466 2/20 0.38
CASP7 P55210 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CFTR P13569 1/20 0.35
HSD17B10 Q99714 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.33
IDO1 P14902 1/20 0.32
TSHR P16473 3/20 0.32
PIK3CA P42336 1/20 0.32
EP300 Q09472 1/20 0.31
KAT8 Q9H7Z6 1/20 0.31
MAPT P10636 3/20 0.31
MEN1 O00255 2/20 0.31
GAA P10253 2/20 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
SCHEMBL818992 0.78 ALDH1A1 (0.42) ALDH1A1TDP1ADRA2BPTGS1CYP3A4
SCHEMBL9059615 0.76 ALDH1A1 (0.43) ALDH1A1TDP1ADRA2BPTGS1CYP3A4
SCHEMBL18403717 0.76 ALDH1A1 (0.43) ALDH1A1TDP1ADRA2BPTGS1CYP3A4
SCHEMBL8564193 0.74 CA1 (0.50) ALDH1A1TDP1ADRA2BPTGS1CYP3A4
SCHEMBL27559565 0.74 ALDH1A1 (0.41) ALDH1A1TDP1ADRA2BPTGS1CYP3A4
SCHEMBL6257867 0.72 ALDH1A1 (0.36) ALDH1A1TDP1ADRA2BPTGS1CYP3A4
SCHEMBL8850104 0.71 ALDH1A1 (0.40) ALDH1A1TDP1CYP3A4SMN1; SMN2HSD17B10
SCHEMBL27333556 0.70 CYP3A4 (0.43) ALDH1A1TDP1ADRA2BPTGS1CYP3A4
SCHEMBL5584654 0.70 CYP3A4 (0.39) ALDH1A1TDP1ADRA2BPTGS1CYP3A4
SCHEMBL895143 0.69 CYP3A4 (0.47) ALDH1A1TDP1ADRA2BPTGS1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8652318-B2 Oleophobic surface coatings XEROX CORPORATION (US) 2014-02-18 US disclosed
US-20110279516-A1 OLEOPHOBIC SURFACE COATINGS XEROX CORPORATION (US) 2011-11-17 US disclosed
EP-2230036-A1 Metal nanoparticle composition with improved adhesion Xerox Corporation (US) 2010-09-22 EP disclosed
US-20100233361-A1 METAL NANOPARTICLE COMPOSITION WITH IMPROVED ADHESION XEROX CORPORATION (US) 2010-09-16 US disclosed