SCHEMBL2933015

SCHEMBL2933015

COc1cc(C(=O)N2CC[C@@H](N)C2)ccc1Nc1cncc(-c2cc3cc(F)ccc3[nH]2)n1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.45
LRRK2 Q5S007 9/20 0.44
TTK P33981 4/20 0.39
HSD11B1 P28845 1/20 0.39
CCNA2 P20248 2/20 0.39
CDK2 P24941 2/20 0.39
DYRK1A Q13627 2/20 0.39
TYK2 P29597 1/20 0.38
ROCK2 O75116 1/20 0.38
PKM P14618 1/20 0.38

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
Hydrochloric Acid SCHEMBL2930596 0.99 KDR (0.45) KDRLRRK2TTKHSD11B1CCNA2
SCHEMBL2931732 0.94 TTK (0.42) LRRK2TTKCCNA2CDK2
Hydrochloric Acid SCHEMBL2930397 0.93 TTK (0.42) LRRK2TTKCCNA2CDK2
SCHEMBL2927501 0.90 KDR (0.53) KDRLRRK2TTKCCNA2CDK2
SCHEMBL2925977 0.90 KDR (0.53) KDRLRRK2TTKCCNA2CDK2
SCHEMBL14269675 0.90 TTK (0.43) LRRK2TTKHSD11B1CCNA2CDK2
Hydrochloric Acid SCHEMBL2934447 0.90 KDR (0.52) KDRLRRK2TTKCCNA2CDK2
Hydrochloric Acid SCHEMBL2934145 0.90 KDR (0.52) KDRLRRK2TTKCCNA2CDK2
SCHEMBL2927754 0.88 MKNK1 (0.42) LRRK2TTKCCNA2CDK2
SCHEMBL2931716 0.88 MKNK1 (0.42) LRRK2TTKCCNA2CDK2

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 4 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

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 KDR 3834/4885LRRK2 309/4885TTK 266/4885

“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.