SCHEMBL2934323

SCHEMBL2934323

Cc1ccc2cc(-c3cncc(Cl)n3)[nH]c2c1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CDK5 Q00535 5/20 0.49
CDK5R1 Q15078 5/20 0.49
ITK Q08881 11/20 0.48
DAO P14920 1/20 0.40
DDO Q99489 1/20 0.40
MAPT P10636 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
AURKA O14965 1/20 0.37
AURKB Q96GD4 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
SCHEMBL13515273 0.82 CDK5 (0.49) CDK5CDK5R1ITKDAODDO
SCHEMBL2933463 0.80 RAB9A (0.51) CDK5CDK5R1ITKMAPTAURKA
SCHEMBL2930773 0.73 CDK5 (0.49) CDK5CDK5R1ITKDAOMAPT
SCHEMBL6491212 0.72 ITK (0.54) ITKDAODDOMAPTRXFP1
SCHEMBL2789205 0.70 CYP19A1 (0.68) CDK5CDK5R1ITKMAPT
SCHEMBL31626907 0.70 KDM4E (0.39) CDK5CDK5R1ITK
SCHEMBL4901225 0.70 CYP11B2 (0.49) MAPT
SCHEMBL13183689 0.70 RAB9A (0.54) ITKDAODDOMAPTRXFP1
SCHEMBL8288035 0.69 DAO (0.52) ITKDAODDOMAPTRXFP1
SCHEMBL1606038 0.69 CDK5 (0.49) CDK5CDK5R1DAOMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2044051-B1 PYRIDINE AND PYRAZINE DERIVATIVES AS MNK KINASE INHIBITORS BIOVITRUM AB PUBL (SE) 2010-01-27 EP disclosed
CN-101472912-A Pyridine and pyrazine derivatives as MNK kinase inhibitors BIOVITRUM AB PUBL (SE) 2009-07-01 CN disclosed
EP-2044051-A1 PYRIDINE AND PYRAZINE DERIVATIVES AS MNK KINASE INHIBITORS BIOVITRUM AB (publ) (SE) 2009-04-08 EP disclosed
US-20080039450-A1 Compounds BIOVITRUM AB (PUBL.) (SE) 2008-02-14 US disclosed
WO-2007147874-A1 PYRIDINE AND PYRAZINE DERIVATIVES AS MNK KINASE INHIBITORS BIOVITRUM AB (PUBL) (SE) 2007-12-27 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-20080039450-A1 Compounds NEK2, CSNK2A3, CSNK2A1 CDK5 240/4885CDK5R1 205/4885ITK 596/4885

“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.