SCHEMBL2931485

SCHEMBL2931485

COc1cc(C(=O)N(C)C2CCN(C)C2)ccc1Nc1cncc(-c2cc3ccccc3o2)n1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 1/20 0.40
TTK P33981 4/20 0.40
HRH3 Q9Y5N1 1/20 0.39
MCHR1 Q99705 3/20 0.39
PTK2 Q05397 3/20 0.38
BRAF P15056 2/20 0.37
EIF4E P06730 2/20 0.37
KCNH2 Q12809 2/20 0.37
MKNK1 Q9BUB5 2/20 0.37
MKNK2 Q9HBH9 2/20 0.37
DNMT1 P26358 1/20 0.37
EHMT2 Q96KQ7 1/20 0.37
CCNA2 P20248 1/20 0.37
CDK2 P24941 1/20 0.37
BRD4 O60885 1/20 0.36
BRDT Q58F21 1/20 0.36

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
Trifluoroacetic Acid SCHEMBL2934144 0.95 PTK2 (0.39) IGF1RTTKHRH3PTK2
SCHEMBL2931771 0.95 HRH3 (0.39) IGF1RTTKHRH3MCHR1BRAF
Trifluoroacetic Acid SCHEMBL2927211 0.90 BRAF (0.39) HRH3MCHR1PTK2BRAFEIF4E
SCHEMBL2932619 0.84 TTK (0.46) IGF1RTTKHRH3MCHR1PTK2
SCHEMBL2931441 0.83 BRAF (0.46) IGF1RTTKHRH3MCHR1PTK2
SCHEMBL2935300 0.83 MCHR1 (0.45) IGF1RTTKHRH3MCHR1PTK2
SCHEMBL2929062 0.81 PIM3 (0.48) BRAF
SCHEMBL2926117 0.80 TTK (0.41) IGF1RTTKHRH3MCHR1PTK2
Trifluoroacetic Acid SCHEMBL2932629 0.80 TTK (0.43) IGF1RTTKHRH3PTK2CCNA2
SCHEMBL2932316 0.80 TTK (0.45) IGF1RTTKHRH3MCHR1PTK2

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 8 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
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 IGF1R 1105/4885TTK 266/4885HRH3 936/4885

“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.