SCHEMBL6220971

SCHEMBL6220971

Cc1ccc(NC(=O)c2ccnc(N3CCOCC3)c2)cc1Nc1ccnc(Cl)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 18/20 1.00
RAF1 P04049 2/20 0.56
BRAF P15056 2/20 0.56

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
SCHEMBL6223233 0.90 MAPK14 (0.81) MAPK14RAF1BRAF
SCHEMBL6220523 0.88 MAPK14 (0.79) MAPK14RAF1BRAF
SCHEMBL6222906 0.88 MAPK14 (1.00) MAPK14RAF1BRAF
SCHEMBL6225054 0.87 MAPK14 (1.00) MAPK14RAF1BRAF
SCHEMBL6222000 0.86 MAPK14 (0.76) MAPK14RAF1BRAF
SCHEMBL6221423 0.85 MAPK14 (0.81) MAPK14
SCHEMBL5897801 0.84 MAPK14 (0.79) MAPK14RAF1BRAF
SCHEMBL6221291 0.84 MAPK14 (0.76) MAPK14RAF1BRAF
SCHEMBL7841389 0.83 MAPK14 (0.71) MAPK14RAF1BRAF
SCHEMBL6294526 0.83 MAPK14 (1.00) MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100415724-C Pyrimidine derivatives ASTRAZENECA AB (SE) 2008-09-03 CN claimed
US-6846827-B1 Pyrimidine derivatives ASTRAZENECA AB (SE) 2005-01-25 US claimed
EP-1226126-B1 PYRIMIDINE DERIVATIVES ASTRAZENECA AB (SE) 2005-01-05 EP claimed
CN-1378537-A Pyrimidine derivatives ASTRAZENECA AB (SE) 2002-11-06 CN claimed
EP-1226126-A1 PYRIMIDINE DERIVATIVES AstraZeneca AB (SE) 2002-07-31 EP claimed
WO-2001027089-A1 PYRIMIDINE DERIVATIVES ASTRAZENECA AB (SE) 2001-04-19 WO claimed
CN-100415724-C Pyrimidine derivatives ASTRAZENECA AB (SE) 2008-09-03 CN disclosed
US-6846827-B1 Pyrimidine derivatives ASTRAZENECA AB (SE) 2005-01-25 US disclosed
EP-1226126-B1 PYRIMIDINE DERIVATIVES ASTRAZENECA AB (SE) 2005-01-05 EP disclosed
CN-1378537-A Pyrimidine derivatives ASTRAZENECA AB (SE) 2002-11-06 CN disclosed
EP-1226126-A1 PYRIMIDINE DERIVATIVES AstraZeneca AB (SE) 2002-07-31 EP disclosed
WO-2001027089-A1 PYRIMIDINE DERIVATIVES ASTRAZENECA AB (SE) 2001-04-19 WO disclosed