SCHEMBL13592016

SCHEMBL13592016

O=C1NC(c2ccc(Cl)cc2)=C2C(=O)N(CCCCS(=O)(=O)O)C(c3ccc(Cl)cc3)=C12

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.34
MMP2 P08253 1/20 0.32
MMP9 P14780 1/20 0.32
DUSP3 P51452 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
GSK3B P49841 1/20 0.30

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
SCHEMBL6857980 0.82 PKM (0.36) PTGS2SMN1; SMN2GSK3B
SCHEMBL21867427 0.82 MCL1 (0.42) PTGS2DUSP3SMN1; SMN2
SCHEMBL13907336 0.76 CHRM2 (0.34)
SCHEMBL13464784 0.74 PTGS2 (0.45) PTGS2MMP2MMP9GSK3B
SCHEMBL6859504 0.74 PTGS2 (0.41) PTGS2GSK3B
SCHEMBL19000851 0.72 MAPK1 (0.39) PTGS2MMP2GSK3B
SCHEMBL19000848 0.72 LSS (0.41)
SCHEMBL19000852 0.72 ALDH1A1 (0.48) PTGS2SMN1; SMN2GSK3B
SCHEMBL13524801 0.71 KDM4E (0.35) PTGS2GSK3B
SCHEMBL13010117 0.70 KDM4E (0.40) PTGS2GSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220204788-A1 Aqueous Inkjet Ink Comprising a Resin AGFA NV (BE) 2022-06-30 US disclosed
US-20170174869-A1 COMPOSITION, METHOD OF MANUFACTURING COMPOSITION, CURABLE COMPOSITION, CURED FILM, NEAR-INFRARED CUT FILTER, SOLID-STATE IMAGING DEVICE, INFRARED SENSOR, AND CAMERA MODULE FUJIFILM CORPORATION (JP) 2017-06-22 US disclosed
US-20170174869-A1 COMPOSITION, METHOD OF MANUFACTURING COMPOSITION, CURABLE COMPOSITION, CURED FILM, NEAR-INFRARED CUT FILTER, SOLID-STATE IMAGING DEVICE, INFRARED SENSOR, AND CAMERA MODULE FUJIFILM CORPORATION (JP) 2017-06-22 US disclosed
US-7632346-B2 Non-aqueous pigment dispersions using dispersion synergists AGFA GRAPHICS NV (BE) 2009-12-15 US disclosed
US-7632346-B2 Non-aqueous pigment dispersions using dispersion synergists AGFA GRAPHICS NV (BE) 2009-12-15 US disclosed
US-7559984-B2 organic pigments; Diketopyrrolopyrrole dyes; for inkjet inks, and coated layers; non-aqueous pigment dispersion exhibiting a high dispersion quality and stability; high image quality with a high optical density AGFA GRAPHICS NV (BE) 2009-07-14 US disclosed
US-7559984-B2 organic pigments; Diketopyrrolopyrrole dyes; for inkjet inks, and coated layers; non-aqueous pigment dispersion exhibiting a high dispersion quality and stability; high image quality with a high optical density AGFA GRAPHICS NV (BE) 2009-07-14 US disclosed
US-20080308005-A1 Non-Aqueous Pigment Dispersions Using Dispersion Synergists AGFA GRAPHICS NV (BE) 2008-12-18 US disclosed
US-20080308005-A1 Non-Aqueous Pigment Dispersions Using Dispersion Synergists AGFA GRAPHICS NV (BE) 2008-12-18 US disclosed
US-20080308006-A1 Diketopyrrolo-Pyrrole Compounds AGFA GRAPHICS NV (BE) 2008-12-18 US disclosed
US-20080308006-A1 Diketopyrrolo-Pyrrole Compounds AGFA GRAPHICS NV (BE) 2008-12-18 US disclosed
WO-2007060257-A2 DIKETOPYRROLO-PYRROLE COMPOUNDS AGFA GRAPHICS NV (BE) 2007-05-31 WO disclosed
EP-1790698-A1 Non-aqueous diketopyrrolo-pyrrole pigment dispersions using dispersion synergists Agfa Graphics N.V. (BE) 2007-05-30 EP 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-20080308006-A1 Diketopyrrolo-Pyrrole Compounds TYR, QDPR, RB1 PTGS2 3630/4885MMP2 4393/4885MMP9 4402/4885

“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.