SCHEMBL13845494

SCHEMBL13845494

[3H]/N=N/c1c(SOOO)cc2cc(NC(=O)Nc3ccc4c(O)c(/N=N/[3H])c(S(=O)(=O)O)cc4c3)ccc2c1O

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CD40 P25942 1/20 0.49
▸ CD40LG P29965 1/20 0.49
▸ PRMT1 Q99873 3/20 0.48
▸ PRMT3 O60678 1/20 0.48
▸ EP300 Q09472 1/20 0.48
▸ PRMT6 Q96LA8 1/20 0.48
▸ ENPP2 Q13822 9/20 0.47
▸ SIRT1 Q96EB6 1/20 0.35
▸ CASP6 P55212 1/20 0.34
▸ CTDSP1 Q9GZU7 1/20 0.34
▸ CA2 P00918 1/20 0.32
▸ CA3 P07451 1/20 0.32
▸ PHLPP2 Q6ZVD8 1/20 0.32
▸ PTPN11 Q06124 1/20 0.32

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
SCHEMBL13046146 0.78 PRMT1 (0.79) CD40CD40LGPRMT1PRMT3EP300
SCHEMBL12975927 0.78 CD40 (0.56) CD40CD40LGPRMT1PRMT3EP300
SCHEMBL13845525 0.78 ENPP2 (0.68) CD40CD40LGPRMT1PRMT3EP300
SCHEMBL13995000 0.75 PRMT3 (0.55) CD40CD40LGPRMT1PRMT3EP300
SCHEMBL14370961 0.73 CD40 (0.69) CD40CD40LGPRMT1PRMT3EP300
SCHEMBL13715874 0.70 PRMT1 (0.44) CD40CD40LGPRMT1PRMT3EP300
SCHEMBL6078254 0.70 PRMT1 (0.58) CD40CD40LGPRMT1PRMT3EP300
SCHEMBL14578748 0.69 PRMT1 (0.41) CD40CD40LGPRMT1PRMT3EP300
SCHEMBL13845510 0.69 ENPP2 (0.57) CD40CD40LGPRMT1PRMT3EP300
SCHEMBL6079026 0.69 PRMT1 (0.60) CD40CD40LGPRMT1PRMT3EP300

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7531009-B2 6-azo-5,5′-dihydroxy-7,7′-disulfo-2-2′ dinaphthylamine derivatives CIBA SPECIALTY CHEMICALS CORPORATION (US) 2009-05-12 — — US disclosed
US-20080196180-A1 6-Azo-5,5'-Dihydroxy-7,7'-Disulfo-2-2' Dinaphthylamine Derivatives CIBA SPECIALTY CHEMICALS CORP. 2008-08-21 — — US 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-20080196180-A1 6-Azo-5,5'-Dihydroxy-7,7'-Disulfo-2-2' Dinaphthylamine Derivatives H1-5, DHODH, DDT CD40 4510/4885CD40LG 3210/4885PRMT1 2442/4885

“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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