SCHEMBL13815199

SCHEMBL13815199

COc1cc(N=Nc2c(C)cc(C)cc2S(=O)(=O)O)c(C)cc1N=Nc1c(SOOO)cc2cc(Nc3ccccc3)ccc2c1O

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 11/20 0.63
▸ PHLPP2 Q6ZVD8 2/20 0.41
▸ ALDH1A1 P00352 1/20 0.39
▸ HIF1A Q16665 1/20 0.39
▸ PTPN1 P18031 2/20 0.38
▸ PRMT1 Q99873 2/20 0.38
▸ PRMT3 O60678 1/20 0.38
▸ EP300 Q09472 1/20 0.38
▸ PRMT6 Q96LA8 1/20 0.38
▸ CD40 P25942 1/20 0.34
▸ CD40LG P29965 1/20 0.34
▸ CARM1 Q86X55 1/20 0.34

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
SCHEMBL13182922 0.90 ENPP2 (0.76) ENPP2PHLPP2ALDH1A1HIF1APTPN1
SCHEMBL14001679 0.90 ENPP2 (0.60) ENPP2PHLPP2ALDH1A1HIF1APTPN1
SCHEMBL29927435 0.89 ENPP2 (0.78) ENPP2PHLPP2ALDH1A1HIF1APTPN1
SCHEMBL14001678 0.88 ENPP2 (0.53) ENPP2PHLPP2ALDH1A1HIF1APRMT1
SCHEMBL14523615 0.87 ENPP2 (0.58) ENPP2PHLPP2ALDH1A1PTPN1PRMT1
SCHEMBL14001682 0.86 ENPP2 (0.53) ENPP2PHLPP2ALDH1A1PTPN1PRMT1
SCHEMBL13088672 0.86 ENPP2 (0.55) ENPP2PHLPP2ALDH1A1HIF1APTPN1
SCHEMBL13088668 0.86 ENPP2 (0.55) ENPP2PHLPP2ALDH1A1HIF1APTPN1
SCHEMBL11911523 0.85 ENPP2 (0.55) ENPP2PHLPP2ALDH1A1HIF1APRMT1
SCHEMBL13088703 0.85 ENPP2 (0.53) ENPP2PHLPP2ALDH1A1PTPN1PRMT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7553359-B2 Stable liquid formulations of anionic dyes CLARIANT FINANCE (BVI) LIMITED (VG) 2009-06-30 — — US disclosed
US-20080194815-A1 Stable Liquid Formulations of Anionic Dyes CLARIANT INTERNATIONAL LTD. (CH) 2008-08-14 — — US disclosed
US-20070083040-A1 Storagestable concentrated aqueous solutions of anionic dis-or tetrazo dyestuffs CLARIANT FINANCE (BVI) LIMITED (VG) 2007-04-12 — — 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-20080194815-A1 Stable Liquid Formulations of Anionic Dyes ADH1A, ADH5, ADH1C ENPP2 4505/4885PHLPP2 1737/4885ALDH1A1 7/4885

“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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