SCHEMBL16200042

SCHEMBL16200042

O=S(=O)(O)c1ccc(Nc2nc(Cl)nc(Nc3ccc(/C=C/c4ccc(Nc5nc(Cl)nc(Nc6ccc(S(=O)(=O)O)cc6)n5)cc4S(=O)(=O)O)c(S(=O)(=O)O)c3)n2)cc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHAT P28329 4/20 0.53
USP2 O75604 1/20 0.53
APEX1 P27695 1/20 0.53
CA9 Q16790 13/20 0.49
CA12 O43570 12/20 0.49
CA1 P00915 12/20 0.49
CA2 P00918 12/20 0.49
CA14 Q9ULX7 4/20 0.49
CA5A P35218 1/20 0.46
CA5B Q9Y2D0 1/20 0.46
ENPP3 O14638 1/20 0.45
ENPP1 P22413 1/20 0.45
ENPP2 Q13822 1/20 0.44
FUT8 Q9BYC5 1/20 0.44
POLB P06746 1/20 0.43

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
SCHEMBL2205546 1.00 CHAT (0.53) CHATUSP2APEX1CA9CA12
SCHEMBL2204854 1.00 CHAT (0.53) CHATUSP2APEX1CA9CA12
Potassium SCHEMBL2206081 0.99 CHAT (0.52) CHATUSP2APEX1CA9CA12
SCHEMBL17565782 0.94 ENPP2 (0.49) CHATUSP2APEX1CA9CA12
SCHEMBL16784075 0.94 ENPP2 (0.49) CHATUSP2APEX1CA9CA12
SCHEMBL2221609 0.92 CA9 (0.62) CA9CA12CA1CA2CA14
SCHEMBL1536256 0.92 CA12 (0.56) CHATUSP2APEX1CA9CA12
SCHEMBL18043806 0.91 CA12 (0.47) CHATUSP2APEX1CA9CA12
SCHEMBL2205601 0.91 CA12 (0.47) CHATUSP2APEX1CA9CA12
SCHEMBL46608 0.91 ENPP2 (0.49) CHATUSP2APEX1CA9CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9487503-B2 Stilbene optical brighteners 3V SIGMA S.P.A. (IT) 2016-11-08 US disclosed
US-9376405-B2 Bis-(triazinylamino)-stilbene derivatives CLARIANT INTERNATIONAL LTD (CH) 2016-06-28 US disclosed
EP-2933253-A1 STILBENE OPTICAL BRIGHTENERS 3V SIGMA S.p.A (IT) 2015-10-21 EP disclosed
US-20140339462-A1 STILBENE OPTICAL BRIGHTENERS 3V SIGMA S.P.A. (IT) 2014-11-20 US disclosed
EP-2518058-B1 Novel bis-(triazinylamino)-stilbene derivatives CLARIANT INT LTD (CH) 2014-10-29 EP 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-20140339462-A1 STILBENE OPTICAL BRIGHTENERS SPIN2B, CYBB, FDFT1 CHAT 1426/4885USP2 2020/4885APEX1 1965/4885

“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.