SCHEMBL2801550

SCHEMBL2801550

COCCOc1ccc(-c2cnc3cccc(-c4ccc(CN5CCOCC5)c(F)c4)c3n2)cc1OC

nearest known ligand 0.79

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 16/20 0.79
JAK1 P23458 16/20 0.79
JAK3 P52333 15/20 0.79
TYK2 P29597 14/20 0.79
ABL1 P00519 1/20 0.47
GAK O14976 1/20 0.42
BDKRB1 P46663 1/20 0.42
PDE4B Q07343 1/20 0.42
ALDH1A1 P00352 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL2799636 0.92 JAK2 (0.78) JAK2JAK1JAK3TYK2ABL1
SCHEMBL2800231 0.89 JAK2 (0.69) JAK2JAK1JAK3TYK2
SCHEMBL2800238 0.89 JAK2 (0.63) JAK2JAK1JAK3TYK2ABL1
SCHEMBL2802144 0.88 JAK2 (1.00) JAK2JAK1JAK3TYK2ABL1
SCHEMBL2800098 0.88 JAK2 (0.87) JAK2JAK1JAK3TYK2ABL1
SCHEMBL2800094 0.88 JAK2 (0.76) JAK2JAK1JAK3TYK2ABL1
SCHEMBL2801586 0.88 JAK2 (0.62) JAK2JAK1JAK3TYK2ALDH1A1
SCHEMBL2801204 0.85 JAK2 (0.89) JAK2JAK1JAK3TYK2ABL1
SCHEMBL27797772 0.83 JAK2 (0.73) JAK2JAK1JAK3TYK2ABL1
SCHEMBL2801004 0.81 JAK2 (0.69) JAK2JAK1JAK3TYK2ABL1

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-2155201-B1 QUINOXALINE DERIVATIVES AS INHIBITORS OF THE TYROSINE KINASE ACTIVITY OF JANUS KINASES NOVARTIS AG (CH) 2012-08-01 EP claimed
US-8193189-B2 Quinoxaline derivatives as tyrosine kinase activity inhibitors NOVARTIS AG (CH) 2012-06-05 US claimed
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-8193189-B2 Quinoxaline derivatives as tyrosine kinase activity inhibitors NOVARTIS AG (CH) 2012-06-05 US 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
US-20100168062-A1 Quinoxaline Derivatives as Tyrosine Kinase Activity Inhibitors NOVARTIS AG 2010-07-01 US disclosed
US-20100168062-A1 Quinoxaline Derivatives as Tyrosine Kinase Activity Inhibitors NOVARTIS AG 2010-07-01 US 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.