SCHEMBL4903032

SCHEMBL4903032

NC(=O)c1ccc(Nc2nccc(-c3ccccn3)n2)cc1

nearest known ligand 0.74

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 3/20 0.74
MAPK10 P53779 1/20 0.74
GSK3B P49841 2/20 0.59
CAMKK2 Q96RR4 2/20 0.59
PIK3CG P48736 1/20 0.59
IKBKB O14920 1/20 0.58
AURKA O14965 2/20 0.58
CDK2 P24941 2/20 0.57
CDK4 P11802 1/20 0.57
AURKB Q96GD4 1/20 0.57
CAMK2D Q13557 2/20 0.55
KCNH2 Q12809 1/20 0.55
JAK2 O60674 1/20 0.55
SYK P43405 7/20 0.54
MKNK1 Q9BUB5 1/20 0.54
MKNK2 Q9HBH9 1/20 0.54
ABL1 P00519 1/20 0.52
BCR P11274 1/20 0.52
PRKCA P17252 1/20 0.52

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
SCHEMBL4903688 0.87 MAPK8 (0.63) MAPK8MAPK10GSK3BCAMKK2PIK3CG
SCHEMBL8246523 0.85 MAPK8 (1.00) MAPK8MAPK10GSK3BCAMKK2PIK3CG
SCHEMBL4894535 0.82 SYK (0.62) IKBKBAURKACDK2CDK4SYK
SCHEMBL7461995 0.82 JAK2 (0.73) IKBKBAURKAJAK2SYK
SCHEMBL7470857 0.81 ABL1 (0.63) IKBKBAURKACDK2CDK4CAMK2D
SCHEMBL21724333 0.81 MAPK8 (0.64) MAPK8MAPK10GSK3BCAMKK2PIK3CG
SCHEMBL4107280 0.81 MAPK8 (0.70) MAPK8MAPK10GSK3BCAMKK2PIK3CG
SCHEMBL4903298 0.81 ABL1 (0.59) AURKAAURKBCAMK2DJAK2SYK
SCHEMBL4899326 0.81 PDGFRB (0.56) MAPK8MAPK10AURKACAMK2DJAK2
SCHEMBL4901365 0.81 CAMKK2 (0.67) MAPK8MAPK10GSK3BCAMKK2PIK3CG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080187575-A1 Pyrimidine Derivatives VICHEM CHEMIE KFT (HU) 2008-08-07 US claimed
EP-1786781-A2 PYRIMIDINE DERIVATIVES GPC Biotech AG (DE) 2007-05-23 EP claimed
WO-2006021458-A2 PYRIMIDINE DERIVATIVES GPC BIOTECH AG (DE) 2006-03-02 WO claimed
US-20080187575-A1 Pyrimidine Derivatives VICHEM CHEMIE KFT (HU) 2008-08-07 US disclosed
EP-1786781-A2 PYRIMIDINE DERIVATIVES GPC Biotech AG (DE) 2007-05-23 EP disclosed
WO-2006021458-A2 PYRIMIDINE DERIVATIVES GPC BIOTECH AG (DE) 2006-03-02 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-20080187575-A1 Pyrimidine Derivatives TYMP, TDP1, PNP MAPK8 3140/4885MAPK10 2491/4885GSK3B 856/4885

“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.