SCHEMBL1479252

SCHEMBL1479252

N=C=O.N=[N+]=NS(=O)(=O)c1ccc(N=C=O)cc1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.39
TSHR P16473 1/20 0.39
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
MAPK1 P28482 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
TRPA1 O75762 1/20 0.32
EPHX2 P34913 1/20 0.32
CYP1A2 P05177 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
SCHEMBL1479253 0.85 CYP3A4 (0.38) CYP3A4TSHRCA1CA2MAPK1
SCHEMBL10936908 0.79 CYP3A4 (0.41) CYP3A4TSHRCA1CA2MAPK1
SCHEMBL182964 0.78 CYP3A4 (0.47) CYP3A4TSHRCA1CA2MAPK1
SCHEMBL28301007 0.75 CYP3A4 (0.61) CYP3A4TSHRCA1CA2MAPK1
SCHEMBL5656809 0.74 CYP3A4 (0.42) CYP3A4TSHRCA1CA2MAPK1
SCHEMBL7180551 0.72 CYP3A4 (0.52) CYP3A4TSHRCA1CA2MAPK1
SCHEMBL278353 0.72 CYP3A4 (0.52) CYP3A4TSHRCA1CA2MAPK1
SCHEMBL5652661 0.70 CYP3A4 (0.67) CYP3A4TSHRCA1CA2MAPK1
SCHEMBL242025 0.69 CA2 (0.68) CYP3A4TSHRCA1CA2TDP1
SCHEMBL10348147 0.69 CYP3A4 (0.48) CYP3A4TSHRCA1CA2MAPK1

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-7914844-B2 Stable dispersions of polymer-coated graphitic nanoplatelets NORTHWESTERN UNIVERSITY (US) 2011-03-29 US disclosed
WO-2008048295-A2 STABLE DISPERSIONS OF POLYMER-COATED GRAPHITIC NANOPLATELETS NORTHWESTERN UNIVERSITY (US) 2008-04-24 WO disclosed
US-20070131915-A1 Stable dispersions of polymer-coated graphitic nanoplatelets NORTHWESTERN UNIVERSITY 2007-06-14 US disclosed