SCHEMBL2204783

SCHEMBL2204783

O=S(=O)(O)c1cccc(Nc2nc(Cl)nc(Nc3ccc(C=Cc4ccc(Nc5nc(Cl)nc(Nc6cccc(S(=O)(=O)O)c6)n5)cc4S(=O)(=O)O)c(S(=O)(=O)O)c3)n2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHAT P28329 3/20 0.56
ENPP3 O14638 1/20 0.56
ENPP1 P22413 1/20 0.56
CA12 O43570 6/20 0.47
CA1 P00915 6/20 0.47
CA2 P00918 6/20 0.47
CA9 Q16790 6/20 0.47
USP2 O75604 1/20 0.46
APEX1 P27695 1/20 0.46
P2RX7 Q99572 1/20 0.43
P2RX2 Q9UBL9 1/20 0.43
P2RY2 P41231 1/20 0.42
P2RY4 P51582 1/20 0.42
P2RY6 Q15077 1/20 0.42
P2RY13 Q9BPV8 1/20 0.42
P2RY12 Q9H244 1/20 0.42
FUT8 Q9BYC5 1/20 0.42
HPGDS O60760 1/20 0.42
ENPP2 Q13822 1/20 0.42
TNNI3K Q59H18 1/20 0.42

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
SCHEMBL2204088 1.00 CHAT (0.56) CHATENPP3ENPP1CA12CA1
Potassium SCHEMBL2205023 0.99 CHAT (0.55) CHATENPP3ENPP1CA12CA1
SCHEMBL10773614 0.94 CHAT (0.48) CHATENPP3ENPP1CA12CA1
SCHEMBL10773637 0.94 CHAT (0.48) CHATENPP3ENPP1CA12CA1
SCHEMBL10487283 0.94 CHAT (0.48) CHATENPP3ENPP1CA12CA1
SCHEMBL10487256 0.93 CHAT (0.48) CHATENPP3ENPP1CA12CA1
SCHEMBL10487271 0.93 CHAT (0.48) CHATENPP3ENPP1CA12CA1
SCHEMBL17565763 0.91 CHAT (0.46) CHATENPP3ENPP1CA12CA1
SCHEMBL1536256 0.91 CA12 (0.56) CHATENPP3ENPP1CA12CA1
Potassium SCHEMBL2203859 0.90 CA12 (0.55) CHATENPP3ENPP1CA12CA1

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 10 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
US-20050161184-A1 Amphoteric and cationic fluorescent whitening agents CIBA SPECIALTY CHEMICALS CORP. 2005-07-28 US disclosed
EP-1485361-A1 AMPHOTERIC AND CATIONIC FLUORESCENT WHITENING AGENTS Ciba SC Holding AG (CH) 2004-12-15 EP disclosed
WO-2003078406-A1 AMPHOTERIC AND CATIONIC FLUORESCENT WHITENING AGENTS CIBA SPECIALTY CHEMICALS HOLDING INC. (US) 2003-09-25 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050161184-A1 Amphoteric and cationic fluorescent whitening agents C3AR1, C1R, AOC3 CHAT 1165/4885ENPP3 1729/4885ENPP1 1848/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.