SCHEMBL4648975

SCHEMBL4648975

O=C1NC=CC1=C1C=CNC1=O

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 1/20 0.30
GSK3B P49841 1/20 0.30
CCR6 P51684 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
Hydrochloric Acid SCHEMBL2262288 0.71
Hydrochloric Acid SCHEMBL2261252 0.71
SCHEMBL616019 0.70
SCHEMBL10591353 0.69
Hydrochloric Acid SCHEMBL28869240 0.67
SCHEMBL17118248 0.64
Pyrrole SCHEMBL16612135 0.61
SCHEMBL12338441 0.60 GSK3A (0.30) GSK3AGSK3BCCR6
Trimethylammonium SCHEMBL28631750 0.60
SCHEMBL28448992 0.60

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
EP-1344778-B1 Bipyrrolinonylidene-type compound, its use as colorant, and method of production thereof DAINIPPON INK & CHEMICALS (JP) 2008-09-03 EP claimed
EP-1344778-B1 Bipyrrolinonylidene-type compound, its use as colorant, and method of production thereof DAINIPPON INK & CHEMICALS (JP) 2008-09-03 EP disclosed
EP-1344778-B1 Bipyrrolinonylidene-type compound, its use as colorant, and method of production thereof DAINIPPON INK & CHEMICALS (JP) 2008-09-03 EP disclosed
CN-100343231-C Dipyrrolinone subunit compound, coloring agent containing said compound and its preparation method DAINIPPON INK & CHEMICALS (JP) 2007-10-17 CN disclosed
US-6740153-B2 AIR OXIDIZING A PYRROLINONE IN THE PRESENCE OF AN ANTHRAQUINONE CATALYST DAINIPPON INK AND CHEMICALS, INC. (JP) 2004-05-25 US disclosed
CN-1443757-A Dipyrrolinone subunit compound, coloring agent containing said compound and its preparation method DAINIPPON INK & CHEMICALS (JP) 2003-09-24 CN disclosed
US-20030172478-A1 Bipyrrolinonylidene-type compound, colorant therewith, and method of producton thereof DAINIPPON INK AND CHEMICALS, INC. (JP) 2003-09-18 US disclosed
EP-1344778-A1 Bipyrrolinonylidene-type compound, its use as colorant, and method of production thereof DAINIPPON INK AND CHEMICALS, INC. (JP) 2003-09-17 EP disclosed
EP-1344778-A1 Bipyrrolinonylidene-type compound, its use as colorant, and method of production thereof DAINIPPON INK AND CHEMICALS, INC. (JP) 2003-09-17 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-20030172478-A1 Bipyrrolinonylidene-type compound, colorant therewith, and method of producton thereof PPOX, NDUFS6, POR GSK3A 4412/4885GSK3B 4478/4885CCR6 3288/4885

“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.