SCHEMBL4824670

SCHEMBL4824670

CSc1ncc(C=O)c(Nc2ccc(F)cc2)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNA2 P20248 2/20 0.47
CDK2 P24941 2/20 0.47
AURKA O14965 1/20 0.46
KDM4E B2RXH2 1/20 0.44
SYK P43405 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA7 P43166 1/20 0.43
MAPK1 P28482 2/20 0.42
HTT P42858 1/20 0.42
MAPT P10636 5/20 0.41
LMNA P02545 4/20 0.41
TP53 P04637 2/20 0.40
THRB P10828 1/20 0.40
PDE4B Q07343 1/20 0.40
PTK2 Q05397 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
POLB P06746 1/20 0.38
NPC1 O15118 1/20 0.37

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
SCHEMBL7795562 0.86 CA1 (0.48) CCNA2CDK2KDM4ESYKCA1
SCHEMBL22719004 0.86 KDM4E (0.44) CCNA2CDK2KDM4ESYKCA1
SCHEMBL4716419 0.86 LMNA (0.47) CCNA2CDK2AURKAKDM4ESYK
SCHEMBL22165445 0.85 SYK (0.42) CCNA2CDK2KDM4ESYKCA1
SCHEMBL23632985 0.82 MAPT (0.43) CCNA2CDK2AURKAKDM4ESYK
SCHEMBL4846993 0.80 MAPK1 (0.39) CCNA2CDK2KDM4ESYKMAPK1
SCHEMBL30597246 0.78 CCNA2 (0.39) CCNA2CDK2KDM4ESYKCA1
SCHEMBL26109252 0.78 CCNA2 (0.39) CCNA2CDK2KDM4ESYKCA1
SCHEMBL27519222 0.78 SYK (0.55) CCNA2CDK2AURKAKDM4ESYK
SCHEMBL14038754 0.78 AURKA (0.45) AURKAMAPK1MAPTLMNAMEN1

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 46 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7449581-B2 6-Substituted pyrido-pyrimidines POCHE PALO ALTO LLC (US) 2008-11-11 US disclosed
US-7449581-B2 6-Substituted pyrido-pyrimidines POCHE PALO ALTO LLC (US) 2008-11-11 US disclosed
US-7449581-B2 6-Substituted pyrido-pyrimidines POCHE PALO ALTO LLC (US) 2008-11-11 US disclosed
US-20080139588-A1 Pyrrolo[2,3-d]pyrimidine cytokine inhibitors THE PROCTER & GAMBLE COMPANY 2008-06-12 US disclosed
US-20080139588-A1 Pyrrolo[2,3-d]pyrimidine cytokine inhibitors THE PROCTER & GAMBLE COMPANY 2008-06-12 US disclosed
US-7320987-B2 6-Alkoxy-pyrido-pyrimidines ROCHE PALO ALTO LLC (US) 2008-01-22 US disclosed
US-7320987-B2 6-Alkoxy-pyrido-pyrimidines ROCHE PALO ALTO LLC (US) 2008-01-22 US disclosed
US-7320987-B2 6-Alkoxy-pyrido-pyrimidines ROCHE PALO ALTO LLC (US) 2008-01-22 US disclosed
US-7319102-B1 Pyrrolo[2,3-d]pyrimidine cytokine inhibitors THE PROCTER & GAMBLE COMPANY (US) 2008-01-15 US disclosed
US-7319102-B1 Pyrrolo[2,3-d]pyrimidine cytokine inhibitors THE PROCTER & GAMBLE COMPANY (US) 2008-01-15 US disclosed
WO-2004014907-A1 6-ALKOXY-PYRIDO-PYRIMIDINES AS P-38 MAP KINASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2004-02-19 WO disclosed
EP-1361880-A2 6-SUBSTITUTED PYRIDO-PYRIMIDINES F. HOFFMANN-LA ROCHE AG (CH) 2003-11-19 EP disclosed
CN-1451005-A 7-oxopyridopyrimidines as inhibitors of cell proliferation HOFFMANN LA ROCHE (CH) 2003-10-22 CN disclosed
US-20030171584-A1 Treating p38 mediated disorders such as arthritis, Crohns disease, irritable bowel syndrome adult respiratory distress syndrome or chronic obstructive pulmonary disease. SYNTEX (U.S.A.) LLC 2003-09-11 US disclosed
US-20030153586-A1 7-oxo-pyridopyrimidines (I) SYNTEX (U.S.A) LLC 2003-08-14 US disclosed
EP-1315726-A1 7- OXO PYRIDOPYRIMIDINES AS INHIBITORS OF CELLULAR PROLIFERATION F. HOFFMANN-LA ROCHE AG (CH) 2003-06-04 EP disclosed
US-6506749-B2 Mitogen-activated protein kinases inhibitors SYNTEX (U.S.A.) LLC 2003-01-14 US disclosed
US-20020137756-A1 Mitogen-activated protein kinases inhibitors SYNTEX (U.S.A.) LLC 2002-09-26 US disclosed
WO-2002064594-A2 6-SUBSTITUTED PYRIDO-PYRIMIDINES F. HOFFMANN-LA ROCHE AG (CH) 2002-08-22 WO disclosed
WO-2002018380-A1 7-OXO PYRIDOPYRIMIDINES AS INHIBITORS OF A CELLULAR PROLIFERATION F. HOFFMANN-LA ROCHE AG (CH) 2002-03-07 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 (4 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-20020137756-A1 Mitogen-activated protein kinases inhibitors MAPK1, MAP3K1, CDK1 CCNA2 243/4885CDK2 27/4885AURKA 249/4885
US-20030153586-A1 7-oxo-pyridopyrimidines (I) AR, PARP1, DPYD CCNA2 92/4885CDK2 14/4885AURKA 277/4885
US-20080139588-A1 Pyrrolo[2,3-d]pyrimidine cytokine inhibitors DPYD, IL1B, IL6 CCNA2 1004/4885CDK2 241/4885AURKA 3601/4885
US-20030171584-A1 Treating p38 mediated disorders such as arthritis, Crohns disease, irritable bowel syndrome adult respiratory distress syndrome or chronic obstructive pulmonary disease. ARRB1, MAPK1, MAPK8 CCNA2 1885/4885CDK2 789/4885AURKA 2910/4885

“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.