SCHEMBL2206071

SCHEMBL2206071

COc1nc(Cl)nc(Nc2ccc(C=Cc3ccc(Nc4nc(Cl)nc(OC)n4)cc3S(=O)(=O)O)c(S(=O)(=O)O)c2)n1.[Na]

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 6/20 0.45
CA2 P00918 6/20 0.45
CA9 Q16790 6/20 0.45
MAPT P10636 3/20 0.45
GAA P10253 1/20 0.45
P2RY2 P41231 1/20 0.44
P2RY12 Q9H244 1/20 0.44
ENPP2 Q13822 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.41
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
CA12 O43570 5/20 0.40
CA14 Q9ULX7 3/20 0.40
CARM1 Q86X55 1/20 0.40
PRMT1 Q99873 1/20 0.40
CHAT P28329 2/20 0.40
USP2 O75604 1/20 0.40
APEX1 P27695 1/20 0.40
ALDH1A1 P00352 1/20 0.40
PTK2 Q05397 1/20 0.39

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
SCHEMBL2204401 0.99 MAPT (0.46) CA1CA2CA9MAPTGAA
Potassium SCHEMBL2219777 0.98 MAPT (0.45) CA1CA2CA9MAPTGAA
SCHEMBL2206639 0.98 MAPT (0.48) CA1CA2CA9MAPTGAA
Potassium SCHEMBL2220089 0.97 MAPT (0.47) CA1CA2CA9MAPTGAA
SCHEMBL2219261 0.96 MAPT (0.46) CA1CA2CA9MAPTGAA
SCHEMBL2218470 0.94 CA1 (0.47) CA1CA2CA9MAPTGAA
SCHEMBL2203489 0.93 CA1 (0.46) CA1CA2CA9MAPTGAA
SCHEMBL2219284 0.92 P2RY2 (0.48) CA1CA2CA9MAPTGAA
SCHEMBL2219341 0.91 P2RY2 (0.47) CA1CA2CA9MAPTGAA
SCHEMBL2217201 0.91 P2RY2 (0.47) CA1CA2CA9MAPTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2716466-B1 THERMAL RECORDING MATERIAL CONTAINING STILBENE DISULPHONIC ACID FLUORESCENT WHITENING AGENT RICOH IND FRANCE SAS (FR) 2016-09-14 EP disclosed
EP-2722190-B1 Optimized undercoat for thermal recording material RICOH IND FRANCE SAS (FR) 2015-12-16 EP disclosed
EP-2722190-A1 Optimized undercoat for thermal recording material Ricoh Industrie France SAS (FR) 2014-04-23 EP disclosed
US-8546300-B2 Thermosensitive recording material and image recording method RICOH COMPANY, LTD. (JP) 2013-10-01 US disclosed
EP-2345541-B1 Thermosensitive recording material and image recording method RICOH CO LTD (JP) 2012-08-29 EP disclosed
US-20110177941-A1 THERMOSENSITIVE RECORDING MATERIAL AND IMAGE RECORDING METHOD RICOH COMPANY, LTD. (JP) 2011-07-21 US disclosed
EP-2345541-A2 Thermosensitive recording material and image recording method Ricoh Company, Ltd. (JP) 2011-07-20 EP disclosed