SCHEMBL8723848

SCHEMBL8723848

O=[N+]([O-])c1ccc(Cl)c2c1Nc1ccccc1S2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SNCA P37840 2/20 0.46
KMT2A Q03164 4/20 0.40
MAPT P10636 4/20 0.40
MEN1 O00255 3/20 0.40
GAA P10253 3/20 0.40
TDP1 Q9NUW8 2/20 0.40
BCHE P06276 2/20 0.40
ACHE P22303 2/20 0.40
NOX1 Q9Y5S8 2/20 0.40
ALOX12 P18054 2/20 0.40
CYP1A2 P05177 1/20 0.40
POLB P06746 1/20 0.40
CYP3A4 P08684 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
ALOX15 P16050 1/20 0.40
MAOA P21397 1/20 0.40
CNR1 P21554 1/20 0.40
PTGS1 P23219 1/20 0.40
SLC6A2 P23975 1/20 0.40
HTR2C P28335 1/20 0.40

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
SCHEMBL11024527 0.83 SNCA (0.46) SNCAKMT2AMAPTMEN1GAA
SCHEMBL32057233 0.78 SNCA (0.55) SNCAKMT2AMAPTMEN1GAA
SCHEMBL3953679 0.78 SNCA (0.55) SNCAKMT2AMAPTMEN1GAA
SCHEMBL27877493 0.75 SNCA (0.55) SNCAKMT2AMAPTMEN1GAA
SCHEMBL10646393 0.74 SNCA (0.51) SNCAKMT2AMAPTMEN1GAA
SCHEMBL31730318 0.71 NOX1 (0.43) SNCAKMT2AMAPTMEN1GAA
SCHEMBL4706849 0.71 NOX1 (0.52) SNCAKMT2AMAPTMEN1GAA
SCHEMBL8725829 0.70 SNCA (0.65) SNCAKMT2AMAPTMEN1GAA
SCHEMBL9698123 0.69 HSD17B10 (0.43) SNCAKMT2AMEN1TDP1CYP1A2
SCHEMBL23936914 0.69 SNCA (0.52) SNCAKMT2AMAPTMEN1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5756356-A COLORIMETRIC TOYO INK MANUFACTURING CO., LTD. (JP) 1998-05-26 US disclosed
EP-0735368-A1 Method of indicating time or temperature-time accumulated value as color change, and materials therefor TOYO INK MANUFACTURING CO., LTD. (JP) 1996-10-02 EP disclosed