SCHEMBL6510065

SCHEMBL6510065

O=S(=O)(Cl)c1ccc(CC[SiH3])cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
HSD17B10 Q99714 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
CA2 P00918 13/20 0.41
CA1 P00915 7/20 0.41
CA12 O43570 6/20 0.41
CA9 Q16790 5/20 0.41
CA14 Q9ULX7 4/20 0.41
CA4 P22748 4/20 0.41
CA6 P23280 3/20 0.41
CA5A P35218 3/20 0.41
CA7 P43166 3/20 0.41
CA5B Q9Y2D0 3/20 0.41
F2 P00734 2/20 0.39
TMPRSS4 Q9NRS4 2/20 0.39
TP53 P04637 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
TSHR P16473 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL11582128 0.86 ALDH1A1 (0.52) ALDH1A1HSD17B10TDP1CA2CA1
SCHEMBL27609957 0.80 ALDH1A1 (0.46) ALDH1A1HSD17B10TDP1CA2CA1
SCHEMBL313925 0.78 ALDH1A1 (0.44) ALDH1A1HSD17B10TDP1CA2CA1
SCHEMBL11583152 0.78 ALDH1A1 (0.62) ALDH1A1HSD17B10TDP1CA2CA1
SCHEMBL617094 0.78 CA2 (0.64) ALDH1A1HSD17B10TDP1CA2CA1
SCHEMBL23691266 0.78 ALDH1A1 (0.44) ALDH1A1HSD17B10TDP1CA2CA1
SCHEMBL1027566 0.78 F2 (0.48) ALDH1A1HSD17B10TDP1CA2CA1
SCHEMBL852835 0.78 CA2 (0.67) ALDH1A1HSD17B10TDP1CA2CA1
SCHEMBL4469516 0.77 CA2 (0.44) ALDH1A1HSD17B10TDP1CA2CA1
SCHEMBL485774 0.77 ALDH1A1 (0.43) ALDH1A1HSD17B10TDP1CA2CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6887451-B2 Process for preparing carbon nanotubes HER MAJESTY THE QUEEN IN RIGHT OF CANADA, AS REPRESENTED BY THE MINISTER OF NATIONAL DEFENCE OF HER MAJESTY'S CANADIAN GOVERNMENT (CA) 2005-05-03 US claimed
WO-2003093174-A1 PROCESS FOR PREPARING CARBON NANOTUBES HER MAJESTY THE QUEEN IN RIGHT OF CANADA, AS REPR ESENTED BY THE MINISTER OF NATIONAL DEFENCE OF HER MAJESTY'S CANADIAN GOVERNMENT (CA) 2003-11-13 WO claimed
US-20030202930-A1 Process for preparing carbon nanotubes HER MAJESTY THE QUEEN IN RIGHT OF CANADA AS REPRESENTED BY THE MINISTER OF NATIONAL DEFENCE OF HER MAJESTY'S CANADIAN GOVERNMENT (CA) 2003-10-30 US claimed