SCHEMBL2086860

SCHEMBL2086860

Cc1ccc(CO)cc1Nc1nccc(-c2sc(=O)n(C)c2C)n1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK2 Q9HBH9 3/20 0.58
CDK2 P24941 3/20 0.53
CLK1 P49759 2/20 0.53
CCNT1 O60563 1/20 0.50
CDK7 P50613 1/20 0.50
CDK9 P50750 1/20 0.50
SYK P43405 3/20 0.43
PLK4 O00444 2/20 0.43
MAPK13 O15264 2/20 0.43
CSF1R P07333 2/20 0.43
TYK2 P29597 2/20 0.43
KDR P35968 2/20 0.43
FLT3 P36888 2/20 0.43
FRK P42685 2/20 0.43
MAPK8 P45983 2/20 0.43
MAPK9 P45984 2/20 0.43
IRAK1 P51617 2/20 0.43
MAPK12 P53778 2/20 0.43
TAOK1 Q7L7X3 2/20 0.43
HIPK4 Q8NE63 2/20 0.43

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
SCHEMBL2088287 0.82 MKNK2 (0.80) MKNK2CDK2CLK1CCNT1CDK7
SCHEMBL2087401 0.81 MKNK2 (0.57) MKNK2CDK2CLK1CCNT1CDK7
SCHEMBL2085427 0.80 MKNK2 (0.56) MKNK2CDK2CLK1CCNT1CDK7
SCHEMBL2084860 0.77 CDK2 (0.64) MKNK2CDK2CLK1CCNT1CDK7
SCHEMBL2086565 0.76 CDK2 (0.55) MKNK2CDK2CLK1CCNT1CDK7
SCHEMBL2086427 0.76 CDK2 (0.60) MKNK2CDK2CLK1CCNT1CDK7
SCHEMBL2086406 0.76 CDK2 (0.60) MKNK2CDK2CLK1CCNT1CDK7
SCHEMBL2087388 0.75 CDK2 (0.67) MKNK2CDK2CLK1CCNT1CDK7
SCHEMBL2086230 0.75 CDK2 (0.65) MKNK2CDK2CLK1CCNT1CDK7
SCHEMBL14073065 0.74 CDK2 (0.58) MKNK2CDK2CLK1CCNT1CDK7

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-1678171-B1 2-AMINO-4-THIAZOLONE-PYRIMIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS CYCLACEL LTD (GB) 2016-09-14 EP claimed
US-7902361-B2 Pyrimidin-4-yl-3, 4-thione compounds and their use in therapy CYCLACEL LIMITED (GB) 2011-03-08 US claimed
JP-2007509117-A 2007-04-12 JP claimed
US-20070021452-A1 Pyrimidin-4-YL-3, 4-thione compounds and their use in therapy CYCLACEL LIMITED (GB) 2007-01-25 US claimed
EP-1678171-A1 PYRIMIDIN-4-YL-3,4-THIONE COMPOUNDS AND THEIR USE IN THERAPY Cyclacel Limited (GB) 2006-07-12 EP claimed
WO-2005042525-A1 PYRIMIDIN-4-YL-3, 4-THIONE COMPOUNDS AND THEIR USE IN THERAPY CYCLACEL LIMITED (GB) 2005-05-12 WO claimed
EP-1678171-B1 2-AMINO-4-THIAZOLONE-PYRIMIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS CYCLACEL LTD (GB) 2016-09-14 EP disclosed
US-7902361-B2 Pyrimidin-4-yl-3, 4-thione compounds and their use in therapy CYCLACEL LIMITED (GB) 2011-03-08 US disclosed
EP-1951307-A2 COMBINATION OF A CDK-INHIBITOR AND A HDAC-INHIBITOR Cyclacel Limited (GB) 2008-08-06 EP disclosed
WO-2007054725-A2 COMBINATION OF A CDK-INHIBITOR AND A HDAC-INHIBITOR CYCLACEL LIMITED (GB) 2007-05-18 WO disclosed
US-20070021452-A1 Pyrimidin-4-YL-3, 4-thione compounds and their use in therapy CYCLACEL LIMITED (GB) 2007-01-25 US disclosed
EP-1678171-A1 PYRIMIDIN-4-YL-3,4-THIONE COMPOUNDS AND THEIR USE IN THERAPY Cyclacel Limited (GB) 2006-07-12 EP disclosed
WO-2005042525-A1 PYRIMIDIN-4-YL-3, 4-THIONE COMPOUNDS AND THEIR USE IN THERAPY CYCLACEL LIMITED (GB) 2005-05-12 WO 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-20070021452-A1 Pyrimidin-4-YL-3, 4-thione compounds and their use in therapy MSRB3, DHFR, CBR3 MKNK2 3756/4885CDK2 459/4885CLK1 2868/4885

“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.