SCHEMBL2799486

SCHEMBL2799486

Cc1cc(-c2cnc3cccc(Br)c3n2)ccc1CN1CCOCC1

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 13/20 0.66
JAK1 P23458 13/20 0.66
JAK3 P52333 13/20 0.66
TYK2 P29597 11/20 0.66
LRRK2 Q5S007 2/20 0.45
CYP2A13 Q16696 2/20 0.43
ABL1 P00519 1/20 0.41
HTT P42858 1/20 0.40
RECQL P46063 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
SCHEMBL2802052 0.89 JAK2 (0.53) JAK2JAK1JAK3TYK2
SCHEMBL2800193 0.83 JAK2 (0.76) JAK2JAK1JAK3TYK2LRRK2
SCHEMBL2800706 0.83 JAK2 (0.54) JAK2JAK1JAK3TYK2
SCHEMBL2801032 0.82 JAK2 (0.73) JAK2JAK1JAK3TYK2LRRK2
SCHEMBL2801038 0.82 JAK2 (0.73) JAK2JAK1JAK3TYK2LRRK2
SCHEMBL2801580 0.80 JAK2 (0.74) JAK2JAK1JAK3TYK2LRRK2
SCHEMBL2799176 0.80 JAK2 (1.00) JAK2JAK1JAK3TYK2LRRK2
SCHEMBL2799448 0.80 JAK2 (0.71) JAK2JAK1JAK3TYK2LRRK2
SCHEMBL2798448 0.79 JAK2 (1.00) JAK2JAK1JAK3TYK2ABL1
SCHEMBL2798401 0.78 JAK2 (0.69) JAK2JAK1JAK3TYK2LRRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101678020-B Quinoxaline derivatives as inhibitors of the tyrosine kinase activity of Janus kinases NOVARTIS AG 2012-08-15 CN disclosed
EP-2155201-B1 QUINOXALINE DERIVATIVES AS INHIBITORS OF THE TYROSINE KINASE ACTIVITY OF JANUS KINASES NOVARTIS AG (CH) 2012-08-01 EP disclosed
US-8193189-B2 Quinoxaline derivatives as tyrosine kinase activity inhibitors NOVARTIS AG (CH) 2012-06-05 US disclosed
US-20100168062-A1 Quinoxaline Derivatives as Tyrosine Kinase Activity Inhibitors NOVARTIS AG 2010-07-01 US disclosed
CN-101678020-A Quinoxaline derivatives as inhibitors of the tyrosine kinase activity of Janus kinases NOVARTIS AG 2010-03-24 CN disclosed
EP-2155201-A2 QUINOXALINE DERIVATIVES AS INHIBITORS OF THE TYROSINE KINASE ACTIVITY OF JANUS KINASES Novartis Ag (CH) 2010-02-24 EP disclosed
WO-2008148867-A2 QUINOXALINE DERIVATIVES AS INHIBITORS OF THE TYROSINE KINASE ACTIVITY OF JANUS KINASES NOVARTIS AG (CH) 2008-12-11 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-20100168062-A1 Quinoxaline Derivatives as Tyrosine Kinase Activity Inhibitors JAK2, JAK1, JAK3 JAK2 1/4885JAK1 2/4885JAK3 3/4885

“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.