SCHEMBL2929459

SCHEMBL2929459

COc1cc(C(=O)N2CCN(C(C)C)CC2)ccc1Nc1cncc(-c2cc3ccccc3[nH]2)n1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
VCP P55072 1/20 0.45
TTK P33981 6/20 0.42
LRRK2 Q5S007 7/20 0.41
KDR P35968 1/20 0.41
CCND1 P24385 1/20 0.40
CDK6 Q00534 1/20 0.40
NUAK1 O60285 1/20 0.40
DYRK1A Q13627 1/20 0.40
TLR9 Q9NR96 1/20 0.40
TLR8 Q9NR97 1/20 0.40
TLR7 Q9NYK1 1/20 0.40
TYK2 P29597 1/20 0.40
CCNA2 P20248 1/20 0.40
CDK2 P24941 1/20 0.40

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
SCHEMBL2930788 0.91 KDR (0.50) TTKLRRK2KDRNUAK1DYRK1A
SCHEMBL14294231 0.91 LRRK2 (0.49) TTKLRRK2TYK2
SCHEMBL2926010 0.89 LRRK2 (0.53) TTKLRRK2KDRNUAK1DYRK1A
SCHEMBL2930665 0.89 LRRK2 (0.53) LRRK2DYRK1A
SCHEMBL2927025 0.88 KDR (0.47) TTKLRRK2KDRNUAK1DYRK1A
SCHEMBL2928684 0.88 LRRK2 (0.44) VCPTTKLRRK2KDRNUAK1
SCHEMBL2930462 0.87 DYRK1A (0.46) TTKLRRK2DYRK1ATLR9TLR8
Trifluoroacetic Acid SCHEMBL2933461 0.86 DYRK1A (0.48) TTKLRRK2KDRNUAK1DYRK1A
SCHEMBL2934905 0.86 TTK (0.46) TTKLRRK2CCNA2CDK2
SCHEMBL2927501 0.85 KDR (0.53) TTKLRRK2KDRCCNA2CDK2

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 10 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 claimed
EP-2044051-A1 PYRIDINE AND PYRAZINE DERIVATIVES AS MNK KINASE INHIBITORS BIOVITRUM AB (publ) (SE) 2009-04-08 EP claimed
US-20080039450-A1 Compounds BIOVITRUM AB (PUBL.) (SE) 2008-02-14 US claimed
WO-2007147874-A1 PYRIDINE AND PYRAZINE DERIVATIVES AS MNK KINASE INHIBITORS BIOVITRUM AB (PUBL) (SE) 2007-12-27 WO claimed
EP-2044051-B1 PYRIDINE AND PYRAZINE DERIVATIVES AS MNK KINASE INHIBITORS BIOVITRUM AB PUBL (SE) 2010-01-27 EP disclosed
EP-2044051-B1 PYRIDINE AND PYRAZINE DERIVATIVES AS MNK KINASE INHIBITORS BIOVITRUM AB PUBL (SE) 2010-01-27 EP disclosed
US-20080039450-A1 Compounds BIOVITRUM AB (PUBL.) (SE) 2008-02-14 US disclosed
US-20080039450-A1 Compounds BIOVITRUM AB (PUBL.) (SE) 2008-02-14 US 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 VCP 2810/4885TTK 266/4885LRRK2 309/4885

“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.