SCHEMBL5000589

SCHEMBL5000589

CC(=O)Nc1ccc2cc(S(=O)(=O)O)c(/N=N/c3cccc(S(=O)(=O)CCOS(=O)(=O)O)c3)c(O)c2c1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PRMT3 O60678 1/20 0.56
EP300 Q09472 1/20 0.56
PRMT6 Q96LA8 1/20 0.56
PRMT1 Q99873 1/20 0.56
ENPP2 Q13822 11/20 0.51
CA2 P00918 1/20 0.49
CA3 P07451 1/20 0.49
CD40 P25942 1/20 0.45
CD40LG P29965 1/20 0.45
THRB P10828 1/20 0.42
PHLPP2 Q6ZVD8 1/20 0.41
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
AMY1A P0DUB6 1/20 0.36

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
SCHEMBL5000592 1.00 PRMT3 (0.56) PRMT3EP300PRMT6PRMT1ENPP2
SCHEMBL29660624 1.00 PRMT3 (0.56) PRMT3EP300PRMT6PRMT1ENPP2
SCHEMBL13880631 0.94 PRMT1 (0.64) PRMT3EP300PRMT6PRMT1ENPP2
SCHEMBL14529309 0.92 PRMT3 (0.58) PRMT3EP300PRMT6PRMT1ENPP2
SCHEMBL13880628 0.92 PRMT3 (0.58) PRMT3EP300PRMT6PRMT1ENPP2
SCHEMBL31519881 0.92 PRMT3 (0.58) PRMT3EP300PRMT6PRMT1ENPP2
SCHEMBL10611423 0.86 PRMT1 (0.67) PRMT3EP300PRMT6PRMT1ENPP2
SCHEMBL29660882 0.86 PRMT1 (0.67) PRMT3EP300PRMT6PRMT1ENPP2
SCHEMBL10611415 0.86 PRMT1 (0.67) PRMT3EP300PRMT6PRMT1ENPP2
SCHEMBL13880639 0.83 PRMT1 (0.59) PRMT3EP300PRMT6PRMT1ENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1373868-A4 IMPROVED AFFINITY MATRICES WITH ENHANCED VISIBILITY FOR MOLECULAR PULL-DOWN AND IMMUNOPRECIPITATION APPLICATIONS SIGMA ALDRICH CO (US) 2006-11-29 EP claimed
US-6887377-B2 Affinity matrices with enhanced visibility for molecular pull-down and immunoprecipitation applications SIGMA-ALDRICH CO. (US) 2005-05-03 US claimed
EP-1373868-A1 IMPROVED AFFINITY MATRICES WITH ENHANCED VISIBILITY FOR MOLECULAR PULL-DOWN AND IMMUNOPRECIPITATION APPLICATIONS Sigma-Aldrich Co. (US) 2004-01-02 EP claimed
US-20020108908-A1 Affinity matrices with enhanced visibility for molecular pull-down and immunoprecipitation applications SIGMA-ALDRICH CO. 2002-08-15 US claimed
WO-2002061406-A1 IMPROVED AFFINITY MATRICES WITH ENHANCED VISIBILITY FOR MOLECULAR PULL-DOWN AND IMMUNOPRECIPITATION APPLICATIONS SIGMA-ALDRICH CO. (US) 2002-08-08 WO claimed
EP-1373868-B1 IMPROVED AFFINITY MATRICES WITH ENHANCED VISIBILITY FOR MOLECULAR PULL-DOWN AND IMMUNOPRECIPITATION APPLICATIONS SIGMA ALDRICH CO LLC (US) 2015-05-20 EP disclosed
US-20090098074-A1 Keratin-Binding Effector Molecules Containing Reactive Dyes BASF SE (DE) 2009-04-16 US disclosed
US-20090098074-A1 Keratin-Binding Effector Molecules Containing Reactive Dyes BASF SE (DE) 2009-04-16 US disclosed
US-7438806-B2 Affinity matrices with enhanced visibility for molecular pull-down and immunoprecipitation applications SIGMA-ALDRICH CO. (US) 2008-10-21 US disclosed
US-20070048800-A1 Affinity matrices with enhanced visibility for molecular pull-down and immunoprecipitation applications SIGMA-ALDRICH CO. (US) 2007-03-01 US disclosed
US-7163633-B2 Affinity matrices with enhanced visibility for molecular pull-down and immunoprecipitation applications SIGMA-ALDRICH CO. (US) 2007-01-16 US disclosed
EP-1373868-A4 IMPROVED AFFINITY MATRICES WITH ENHANCED VISIBILITY FOR MOLECULAR PULL-DOWN AND IMMUNOPRECIPITATION APPLICATIONS SIGMA ALDRICH CO (US) 2006-11-29 EP disclosed
US-6887377-B2 Affinity matrices with enhanced visibility for molecular pull-down and immunoprecipitation applications SIGMA-ALDRICH CO. (US) 2005-05-03 US disclosed
US-20050079554-A1 Affinity matrices with enhanced visibility for molecular pull-down and immunoprecipitation applications SIGMA-ALDRICH CO. 2005-04-14 US disclosed
EP-1373868-A1 IMPROVED AFFINITY MATRICES WITH ENHANCED VISIBILITY FOR MOLECULAR PULL-DOWN AND IMMUNOPRECIPITATION APPLICATIONS Sigma-Aldrich Co. (US) 2004-01-02 EP disclosed
US-20020108908-A1 Affinity matrices with enhanced visibility for molecular pull-down and immunoprecipitation applications SIGMA-ALDRICH CO. 2002-08-15 US disclosed
WO-2002061406-A1 IMPROVED AFFINITY MATRICES WITH ENHANCED VISIBILITY FOR MOLECULAR PULL-DOWN AND IMMUNOPRECIPITATION APPLICATIONS SIGMA-ALDRICH CO. (US) 2002-08-08 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 (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-20090098074-A1 Keratin-Binding Effector Molecules Containing Reactive Dyes KRT18, KLK3, KLKB1 PRMT3 1298/4885EP300 3664/4885PRMT6 1727/4885

“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.