SCHEMBL6209314

SCHEMBL6209314

O=S(=O)(O)Oc1ccc(Nc2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.53
MAPT P10636 4/20 0.53
GAA P10253 2/20 0.53
HSP90AA1 P07900 1/20 0.53
SNCA P37840 1/20 0.53
CA12 O43570 3/20 0.51
CA1 P00915 3/20 0.51
CA2 P00918 3/20 0.51
CA9 Q16790 3/20 0.51
MEN1 O00255 1/20 0.51
PTPN7 P35236 1/20 0.51
KMT2A Q03164 1/20 0.51
PTPN12 Q05209 1/20 0.51
HSD17B10 Q99714 4/20 0.50
TSHR P16473 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
FABP1 P07148 1/20 0.50
ALOX15 P16050 1/20 0.50
ALOX12 P18054 1/20 0.50
PTGS1 P23219 1/20 0.50

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
Formaldehyde SCHEMBL7776238 0.96 ALDH1A1 (0.50) ALDH1A1MAPTGAAHSP90AA1SNCA
SCHEMBL9480004 0.83 TDP1 (0.62) ALDH1A1MAPTGAAHSP90AA1SNCA
SCHEMBL138895 0.81 CA2 (0.58) MAPTGAACA12CA1CA2
SCHEMBL9481408 0.81 ALDH1A1 (0.53) ALDH1A1MAPTGAAHSP90AA1SNCA
Diphenylamine SCHEMBL9158326 0.79 HSD17B10 (0.55) ALDH1A1MAPTGAAHSP90AA1SNCA
Diphenylamine SCHEMBL28015231 0.79 HSD17B10 (0.55) ALDH1A1MAPTGAAHSP90AA1SNCA
Diphenylamine SCHEMBL9158323 0.79 HSD17B10 (0.55) ALDH1A1MAPTGAAHSP90AA1SNCA
SCHEMBL31498221 0.79 ALDH1A1 (0.48) ALDH1A1MAPTGAAHSP90AA1SNCA
Water SCHEMBL2134977 0.79 CA1 (0.56) MAPTGAACA12CA1CA2
SCHEMBL17456405 0.79 CA1 (0.56) MAPTGAACA12CA1CA2

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
EP-1508072-A2 ACID GENERATING AGENTS AND THEIR USE IN PROCESSES FOR IMAGING RADIATION-SENSITIVE ELEMENTS Kodak Polychrome Graphics LLC (US) 2005-02-23 EP disclosed
US-6787281-B2 SUCH AS 2-METHOXY-4-(PHENYLAMINO)-BENZENEDIAZONIUM DODECYL SULFATE (MSDS), WHICH DOES NOT CONTAIN OZONE DEPLETION ELEMENTS (FLUORINE, HEAVY METALS); POLLUTION CONTROL; LITHOGRAPHY KODAK POLYCHROME GRAPHICS LLC 2004-09-07 US disclosed
WO-2004036314-A2 ACID GENERATING AGENTS AND THEIR USE IN PROCESSES FOR IMAGING RADIATION-SENSITIVE ELEMENTS KODAK POLYCHROME GRAPHICS LLC (US) 2004-04-29 WO disclosed
US-20030219673-A1 Selected acid generating agents and their use in processes for imaging radiation-sensitive elements FPC INC. 2003-11-27 US disclosed