SCHEMBL4688166

SCHEMBL4688166

COc1cc[nH]c1/C=C1\C(=O)Nc2ccc(N)c(N)c21

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CCNE1 P24864 20/20 0.67
CDK2 P24941 20/20 0.67
CCNE2 O96020 10/20 0.67

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
SCHEMBL4688173 1.00 CCNE1 (0.67) CCNE1CDK2CCNE2
SCHEMBL7819721 0.87 CCNE1 (0.62) CCNE1CDK2CCNE2
SCHEMBL7819725 0.87 CCNE1 (0.62) CCNE1CDK2CCNE2
SCHEMBL7819720 0.85 CCNE1 (0.59) CCNE1CDK2CCNE2
SCHEMBL7819722 0.85 CCNE1 (0.59) CCNE1CDK2CCNE2
SCHEMBL14289941 0.83 PDPK1 (0.56) CCNE1CDK2CCNE2
SCHEMBL7830190 0.82 CCNE1 (0.55) CCNE1CDK2CCNE2
SCHEMBL6977943 0.82 CCNE2 (0.64) CCNE1CDK2CCNE2
SCHEMBL6977953 0.82 CCNE2 (0.64) CCNE1CDK2CCNE2
SCHEMBL7830189 0.82 CCNE1 (0.55) CCNE1CDK2CCNE2

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
EP-1149106-B1 4,5-AZOLO-OXINDOLES HOFFMANN LA ROCHE (CH) 2003-03-19 EP claimed
EP-1149106-A2 4,5-AZOLO-OXINDOLES F. HOFFMANN-LA ROCHE AG (CH) 2001-10-31 EP claimed
WO-2000035920-A2 4,5-AZOLO-OXINDOLES F. HOFFMANN-LA ROCHE AG (CH) 2000-06-22 WO claimed
EP-1149105-B1 4,5-PYRAZINOXINDOLES AS PROTEIN KINASE INHIBITORS HOFFMANN LA ROCHE (CH) 2008-02-27 EP disclosed
EP-1149105-B1 4,5-PYRAZINOXINDOLES AS PROTEIN KINASE INHIBITORS HOFFMANN LA ROCHE (CH) 2008-02-27 EP disclosed
EP-1149106-B1 4,5-AZOLO-OXINDOLES HOFFMANN LA ROCHE (CH) 2003-03-19 EP disclosed
EP-1149105-A1 4,5-PYRAZINOXINDOLES AS PROTEIN KINASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2001-10-31 EP disclosed
EP-1149106-A2 4,5-AZOLO-OXINDOLES F. HOFFMANN-LA ROCHE AG (CH) 2001-10-31 EP disclosed
US-6221867-B1 TREATING RHEUMATOID ARTHRITIS HOFFMANN-LA ROCHE INC. 2001-04-24 US disclosed
US-6197804-B1 KINASE INHIBITORS; ANTICANCER AGENTS HOFFMANN-LA ROCHE INC. 2001-03-06 US disclosed
US-6153634-A FOR THERAPY AND PROPHYLAXIS OF CANCER TUMORS; INHIBITOR OFCYCLIN-DEPENDENT KINASES (CDKS) HOFFMANN-LA ROCHE INC. (US) 2000-11-28 US disclosed
WO-2000035921-A1 4,5-PYRAZINOXINDOLES AS PROTEIN KINASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2000-06-22 WO disclosed
WO-2000035920-A2 4,5-AZOLO-OXINDOLES F. HOFFMANN-LA ROCHE AG (CH) 2000-06-22 WO disclosed