SCHEMBL6958819

SCHEMBL6958819

COc1cc[nH]c1C=C1C(=O)Nc2cccc(C#CCOc3ccccc3)c21

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 1/20 0.59
CCNE1 P24864 19/20 0.55
CDK2 P24941 19/20 0.55
CCNE2 O96020 16/20 0.51

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
SCHEMBL6958812 1.00 MAPK8 (0.59) MAPK8CCNE1CDK2CCNE2
SCHEMBL6974884 0.89 CCNE1 (0.57) MAPK8CCNE1CDK2CCNE2
SCHEMBL6974877 0.89 CCNE1 (0.57) MAPK8CCNE1CDK2CCNE2
SCHEMBL6962587 0.86 CCNE1 (0.61) MAPK8CCNE1CDK2CCNE2
SCHEMBL6962581 0.86 CCNE1 (0.61) MAPK8CCNE1CDK2CCNE2
SCHEMBL6972273 0.85 MAPK8 (0.59) MAPK8CCNE1CDK2CCNE2
SCHEMBL6979054 0.85 CCNE1 (0.57) MAPK8CCNE1CDK2CCNE2
SCHEMBL6972263 0.85 MAPK8 (0.59) MAPK8CCNE1CDK2CCNE2
SCHEMBL6979043 0.85 CCNE1 (0.57) MAPK8CCNE1CDK2CCNE2
SCHEMBL6976285 0.85 CCNE1 (0.70) MAPK8CCNE1CDK2CCNE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1149092-B1 4- AND 5-ALKYNYLOXINDOLES AND 4- AND 5-ALKENYLOXINDOLES HOFFMANN LA ROCHE (CH) 2003-10-29 EP claimed
CN-1331689-A 4-and 5-alkynyloxindoles and 4-and 5-alkenyloxindoles HOFFMANN LA ROCHE (CH) 2002-01-16 CN claimed
US-6313310-B1 JUN N-TERMINAL KINASE (JNK) ENZYME INHIBITORS; ANTIINFLAMMATORY AGENTS; RHEUMATIC ARTHRITIS AND NEURO-DEGENERATIVE DISEASE TREATMENT HOFFMANN-LA ROCHE INC. 2001-11-06 US claimed
EP-1149092-A2 4- AND 5-ALKYNYLOXINDOLES AND 4- AND 5-ALKENYLOXINDOLES F. HOFFMANN-LA ROCHE AG (CH) 2001-10-31 EP claimed
WO-2000035906-A2 4- AND 5-ALKYNYLOXINDOLES AND 4- AND 5-ALKENYLOXINDOLES F. HOFFMANN-LA ROCHE AG (CH) 2000-06-22 WO claimed
EP-1149092-B1 4- AND 5-ALKYNYLOXINDOLES AND 4- AND 5-ALKENYLOXINDOLES HOFFMANN LA ROCHE (CH) 2003-10-29 EP disclosed
CN-1331689-A 4-and 5-alkynyloxindoles and 4-and 5-alkenyloxindoles HOFFMANN LA ROCHE (CH) 2002-01-16 CN disclosed
US-6313310-B1 JUN N-TERMINAL KINASE (JNK) ENZYME INHIBITORS; ANTIINFLAMMATORY AGENTS; RHEUMATIC ARTHRITIS AND NEURO-DEGENERATIVE DISEASE TREATMENT HOFFMANN-LA ROCHE INC. 2001-11-06 US disclosed
EP-1149092-A2 4- AND 5-ALKYNYLOXINDOLES AND 4- AND 5-ALKENYLOXINDOLES F. HOFFMANN-LA ROCHE AG (CH) 2001-10-31 EP disclosed
WO-2000035906-A2 4- AND 5-ALKYNYLOXINDOLES AND 4- AND 5-ALKENYLOXINDOLES F. HOFFMANN-LA ROCHE AG (CH) 2000-06-22 WO disclosed