SCHEMBL6950992

SCHEMBL6950992

Cn1cc(C2=C(c3ccccc3)C(=O)NC2=O)c2ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 5/20 0.94
CCNE2 O96020 1/20 0.85
CDK4 P11802 1/20 0.85
CCND1 P24385 1/20 0.85
CCNE1 P24864 1/20 0.85
CDK2 P24941 1/20 0.85
PRKCA P17252 3/20 0.74

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
SCHEMBL30319849 0.92 CCNE2 (1.00) GSK3BCCNE2CDK4CCND1CCNE1
SCHEMBL5686048 0.92 CCNE2 (1.00) GSK3BCCNE2CDK4CCND1CCNE1
SCHEMBL8167092 0.89 CDK2 (0.76) GSK3BCCNE2CDK4CCND1CCNE1
SCHEMBL8153807 0.89 GSK3B (0.81) GSK3BCCNE2CDK4CCND1CCNE1
SCHEMBL8166880 0.89 GSK3B (0.81) GSK3BCCNE2CDK4CCND1CCNE1
SCHEMBL8154477 0.87 GSK3B (0.77) GSK3BCCNE2CDK4CCND1CCNE1
SCHEMBL8154180 0.87 GSK3B (0.76) GSK3BCCNE2CDK4CCND1CCNE1
SCHEMBL8161378 0.87 GSK3B (0.77) GSK3BCCNE2CDK4CCND1CCNE1
SCHEMBL8162888 0.86 CCNE2 (0.76) GSK3BCCNE2CDK4CCND1CCNE1
SCHEMBL4427029 0.86 GSK3B (1.00) GSK3BCCNE2CDK4CCND1CCNE1

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-20030087949-A1 Indolylpyrrole derivatives and cell death inhibitors SAGAMI CHEMICAL RESEARCH CENTER (JP) 2003-05-08 US disclosed
EP-1275646-A1 INDOLYLPYRROLE DERIVATIVES AND CELL DEATH INHIBITORS SAGAMI CHEMICAL RESEARCH CENTER (JP) 2003-01-15 EP disclosed
US-RE36736-E Substituted pyrroles HOFFMAN-LA ROCHE INC. (US) 2000-06-13 US disclosed
EP-0540956-B1 Process for the manufacture of substituted maleimides HOFFMANN LA ROCHE (CH) 1997-09-03 EP disclosed
US-5399712-A Protein kinase C inhibitor HOFFMANN-LA ROCHE INC. (US) 1995-03-21 US disclosed
EP-0540956-A1 Process for the manufacture of substituted maleimides F. HOFFMANN-LA ROCHE AG (CH) 1993-05-12 EP disclosed
EP-0328026-B1 SUBSTITUTED PYRROLES F. HOFFMANN-LA ROCHE AG (CH) 1993-04-28 EP disclosed
US-5057614-A Antiinflammatory, immunology, bronchodilator agents, cardiovascular disorders HOFFMANN-LA ROCHE INC. (US) 1991-10-15 US disclosed
EP-0328026-A1 Substituted pyrroles F. HOFFMANN-LA ROCHE AG (CH) 1989-08-16 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-20030087949-A1 Indolylpyrrole derivatives and cell death inhibitors AIFM1, BAX, CASP3 GSK3B 181/4885CCNE2 1210/4885CDK4 100/4885

“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.