SCHEMBL6648686

SCHEMBL6648686

Cc1ccc(-c2ccccc2C(N)=O)cc1Nc1nccc(-c2ccncc2)n1

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CAMKK2 Q96RR4 6/20 0.67
ABL1 P00519 8/20 0.52
BCR P11274 7/20 0.52
PIK3CG P48736 3/20 0.51
GSK3B P49841 2/20 0.51
PDGFRB P09619 6/20 0.50
PDGFRA P16234 6/20 0.50
MAPK8 P45983 3/20 0.50
SYK P43405 1/20 0.50
PRKCA P17252 4/20 0.49
EGFR P00533 4/20 0.49
CCNT1 O60563 1/20 0.48
CDK9 P50750 1/20 0.48
JAK3 P52333 1/20 0.47
BTK Q06187 1/20 0.47
ITK Q08881 1/20 0.47

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
SCHEMBL30612698 0.90 ABL1 (0.66) CAMKK2ABL1BCRPDGFRBPDGFRA
SCHEMBL3051385 0.90 ABL1 (0.66) CAMKK2ABL1BCRPDGFRBPDGFRA
SCHEMBL6599955 0.84 CAMKK2 (0.59) CAMKK2ABL1BCRPIK3CGGSK3B
SCHEMBL4904288 0.83 CAMKK2 (0.71) CAMKK2ABL1BCRPIK3CGGSK3B
SCHEMBL30921131 0.82 ABL1 (0.58) CAMKK2ABL1BCRPDGFRBPDGFRA
SCHEMBL22169842 0.77 CAMKK2 (0.63) CAMKK2ABL1BCRPIK3CGGSK3B
SCHEMBL6600084 0.77 ABL1 (0.49) CAMKK2ABL1BCRPIK3CGGSK3B
SCHEMBL2580846 0.77 ABL1 (0.74) CAMKK2ABL1BCRPIK3CGPDGFRB
SCHEMBL7466961 0.76 SRC (0.63) CAMKK2ABL1BCRPIK3CGPDGFRB
SCHEMBL7475168 0.76 CCNB2 (0.55) CAMKK2ABL1BCRPIK3CGGSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1395261-A2 PYRIDYLPYRIMIDINE DERIVATIVES AS EFFECTIVE COMPOUNDS AGAINST PRION DISEASES Axxima Pharmaceuticals Aktiengesellschaft (DE) 2004-03-10 EP disclosed
WO-2002093164-A2 PYRIDYLPYRIMIDINE DERIVATIVES AS EFFECTIVE COMPOUNDS AGAINST PRION DISEASES AXXIMA PHARMACEUTICALS AG (DE) 2002-11-21 WO disclosed