SCHEMBL4166243

SCHEMBL4166243

O=S(=O)(O)OCCS(=O)(=O)c1ccc(/N=N/c2c(S(=O)(=O)O)cc3cc(Nc4nc(Cl)nc(Cl)n4)ccc3c2O)cc1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PRMT1 Q99873 3/20 0.61
▸ CARM1 Q86X55 1/20 0.61
▸ CD40 P25942 1/20 0.48
▸ CD40LG P29965 1/20 0.48
▸ ENPP2 Q13822 10/20 0.47
▸ PRMT3 O60678 1/20 0.47
▸ EP300 Q09472 1/20 0.47
▸ PRMT6 Q96LA8 1/20 0.47
▸ FUT8 Q9BYC5 1/20 0.46
▸ THRB P10828 1/20 0.43
▸ CA2 P00918 1/20 0.42
▸ CA3 P07451 1/20 0.42
▸ PHLPP2 Q6ZVD8 1/20 0.39

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
SCHEMBL3698096 1.00 PRMT1 (0.61) PRMT1CARM1CD40CD40LGENPP2
SCHEMBL14388947 0.94 PRMT1 (0.53) PRMT1CARM1CD40CD40LGENPP2
SCHEMBL14388852 0.92 PRMT1 (0.53) PRMT1CARM1CD40CD40LGENPP2
SCHEMBL14388920 0.90 FUT8 (0.54) PRMT1CARM1CD40CD40LGENPP2
SCHEMBL15545001 0.89 PRMT1 (0.71) PRMT1CARM1CD40CD40LGENPP2
SCHEMBL15545004 0.89 PRMT1 (0.71) PRMT1CARM1CD40CD40LGENPP2
SCHEMBL14388936 0.88 PRMT1 (0.56) PRMT1CARM1CD40CD40LGENPP2
SCHEMBL11671160 0.88 PRMT1 (0.68) PRMT1CARM1CD40CD40LGENPP2
SCHEMBL29770470 0.86 PRMT1 (0.61) PRMT1CARM1CD40CD40LGENPP2
SCHEMBL13880626 0.85 FUT8 (0.50) PRMT1CARM1CD40CD40LGENPP2

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-2877538-B1 HOME FABRIC DYE PRODUCT HENKEL AG & CO KGAA (DE) 2017-09-06 — — EP claimed
US-9403987-B2 Charged particles BASF SE (DE) 2016-08-02 — — US disclosed
US-9403987-B2 Charged particles BASF SE (DE) 2016-08-02 — — US disclosed
US-8367823-B2 Colorants based N-halamines compositions and method of making and using BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2013-02-05 — — US disclosed
US-20120229884-A1 CHARGED PARTICLES BASF SE (DE) 2012-09-13 — — US disclosed
US-20120229884-A1 CHARGED PARTICLES BASF SE (DE) 2012-09-13 — — US disclosed
WO-2010149505-A2 CHARGED PARTICLES BASF SE (DE) 2010-12-29 — — WO disclosed
US-20090074825-A1 COLORANTS BASED N-HALAMINES COMPOSITIONS AND METHOD OF MAKING AND USING BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2009-03-19 — — US disclosed
US-20070271711-A1 Dye Mixtures of Fibre-Reactive Azo Dyes Production and Use Thereof DYSTAR TEXTILFARBEN GMBH & CO., DEUTSCHLAND KG (DE) 2007-11-29 — — US disclosed
WO-2007039573-A2 AZO REACTIVE DYES AND MIXTURES OF FIBER-REACTIVE AZO DYES, THEIR PREPARATION AND THEIR USE DYSTAR TEXTILFARBEN GMBH & CO DEUTSCHLAND KG (DE) 2007-04-12 — — 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-20090074825-A1 COLORANTS BASED N-HALAMINES COMPOSITIONS AND METHOD OF MAKING AND USING TYR, MPO, NISCH PRMT1 949/4885CARM1 988/4885CD40 4885/4885
US-20120229884-A1 CHARGED PARTICLES POLE3, POLD3, IPO4 PRMT1 4254/4885CARM1 4276/4885CD40 4303/4885

“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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