SCHEMBL13151976

SCHEMBL13151976

COc1cc(/N=N/c2cc(S(=O)(=O)O)cc(S(=O)(=O)O)c2)ccc1Nc1nc(O)nc(Nc2ccc(/N=N/c3cc(S(=O)(=O)O)cc(S(=O)(=O)O)c3)c(C)c2)n1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 8/20 0.46
▸ PHLPP2 Q6ZVD8 2/20 0.40
▸ FUT8 Q9BYC5 1/20 0.37
▸ CHAT P28329 1/20 0.36
▸ BRD4 O60885 2/20 0.35
▸ PTGS2 P35354 1/20 0.34
▸ MEN1 O00255 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ CARM1 Q86X55 1/20 0.33
▸ PRMT1 Q99873 1/20 0.33
▸ PTK2 Q05397 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ HIF1A Q16665 1/20 0.33

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
SCHEMBL13152005 0.92 ENPP2 (0.46) ENPP2PHLPP2FUT8CHATKMT2A
SCHEMBL13151907 0.89 PTGS2 (0.42) ENPP2PHLPP2BRD4PTGS2MEN1
SCHEMBL13151849 0.88 ENPP2 (0.39) ENPP2PHLPP2FUT8CHATBRD4
SCHEMBL13151865 0.88 ENPP2 (0.57) ENPP2PHLPP2FUT8CHATMEN1
SCHEMBL13151869 0.87 ENPP2 (0.49) ENPP2PHLPP2FUT8CHATMEN1
SCHEMBL13151859 0.86 ENPP2 (0.47) ENPP2PHLPP2FUT8CHATMEN1
SCHEMBL13151899 0.84 ENPP2 (0.52) ENPP2PHLPP2FUT8CHATBRD4
SCHEMBL13879847 0.83 ENPP2 (0.51) ENPP2PHLPP2FUT8CHATBRD4
SCHEMBL13151992 0.82 ENPP2 (0.53) ENPP2PHLPP2FUT8BRD4MEN1
SCHEMBL13151909 0.82 ENPP2 (0.49) ENPP2PHLPP2FUT8CHATMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140288280-A1 CYSTEINE ENGINEERED ANTIBODIES AND CONJUGATES GENENTECH, INC. (US) 2014-09-25 — — US disclosed
US-7799122-B2 Azo compounds FUJIFILM IMAGING COLORANTS LIMITED (GB) 2010-09-21 — — US disclosed
US-7799122-B2 Azo compounds FUJIFILM IMAGING COLORANTS LIMITED (GB) 2010-09-21 — — US disclosed
US-20100151212-A1 Azo compounds FUJIFILM IMAGING COLORANTS LIMITED (GB) 2010-06-17 — — US disclosed
US-20100151212-A1 Azo compounds FUJIFILM IMAGING COLORANTS LIMITED (GB) 2010-06-17 — — US disclosed
WO-2007012828-A2 AZO COMPOUNDS FUJIFILM IMAGING COLORANTS LIMITED (GB) 2007-02-01 — — 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 (2 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-20140288280-A1 CYSTEINE ENGINEERED ANTIBODIES AND CONJUGATES CTH, LNPEP, CARS1 ENPP2 4311/4885PHLPP2 1984/4885FUT8 370/4885
US-20100151212-A1 Azo compounds PAH, CYP1A1, RB1 ENPP2 3818/4885PHLPP2 2220/4885FUT8 3030/4885

“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.

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