SCHEMBL6123733

SCHEMBL6123733

Cc1c(N)ccc2c(O)cc(S(=O)(=O)O)cc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP6 P55212 5/20 0.54
NSD2 O96028 4/20 0.54
DUSP3 P51452 2/20 0.54
PTPN5 P54829 2/20 0.54
PTPN11 Q06124 2/20 0.54
HSD17B10 Q99714 4/20 0.50
NT5E P21589 4/20 0.50
ALDH1A1 P00352 4/20 0.50
CYP2C9 P11712 3/20 0.49
CYP2C19 P33261 2/20 0.49
PRMT1 Q99873 1/20 0.47
CTDSP1 Q9GZU7 1/20 0.45
GAA P10253 2/20 0.41
PLCG1 P19174 1/20 0.41
DNMT1 P26358 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CASP7 P55210 1/20 0.40
PHLPP2 Q6ZVD8 1/20 0.40
TDP1 Q9NUW8 2/20 0.40
TSHR P16473 1/20 0.40

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
SCHEMBL4881379 0.87 CASP6 (0.57) CASP6NSD2DUSP3PTPN5PTPN11
SCHEMBL9188809 0.84 CASP6 (0.54) CASP6NSD2DUSP3PTPN5PTPN11
SCHEMBL1413168 0.83 CASP6 (0.57) CASP6NSD2DUSP3PTPN5PTPN11
SCHEMBL29415548 0.82 CASP6 (0.55) CASP6NSD2DUSP3PTPN5PTPN11
SCHEMBL713434 0.82 CASP6 (0.55) CASP6NSD2DUSP3PTPN5PTPN11
SCHEMBL29516387 0.82 CASP6 (0.55) CASP6NSD2DUSP3PTPN5PTPN11
SCHEMBL27504483 0.80 CASP6 (0.50) CASP6NSD2DUSP3PTPN5PTPN11
SCHEMBL6530355 0.79 ALDH1A1 (0.63) CASP6NSD2DUSP3PTPN5PTPN11
SCHEMBL6205724 0.79 CASP6 (0.55) CASP6NSD2DUSP3PTPN5PTPN11
SCHEMBL9289833 0.78 CASP6 (0.51) CASP6NSD2DUSP3PTPN5PTPN11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140299020-A1 WATER-BASED BLACK INK COMPOSITION, INKJET RECORDING METHOD USING SAME, AND COLORED BODY NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2014-10-09 US disclosed
US-8167991-B2 Trisazo compound, ink composition, recording method, and colored article NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2012-05-01 US disclosed
US-20090136720-A1 Azo Compound, Ink Composition, Recording Method and Colored Article NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2009-05-28 US disclosed
US-20090118479-A1 Azo compound, ink composition, recording method and colored article NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2009-05-07 US disclosed
US-7503967-B2 Azo compound, ink composition and colored article NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2009-03-17 US disclosed
US-7503965-B2 Azo compound, ink composition, and colored object NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2009-03-17 US disclosed
US-20090062545-A1 Trisazo Compound, Ink Composition, Recording Method, and Colored Article NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2009-03-05 US disclosed
US-20080292792-A1 Azo Compound, Ink Composition, and Colored Object NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2008-11-27 US disclosed
US-20080193660-A1 Azo Compound, Ink Composition and Colored Article NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2008-08-14 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-20090062545-A1 Trisazo Compound, Ink Composition, Recording Method, and Colored Article JAK1, TMT1A, CDK1 CASP6 3867/4885NSD2 1429/4885DUSP3 2053/4885

“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.