SCHEMBL9100115

SCHEMBL9100115

CN1CCN(c2ccc(-c3cnc4cccc(-c5cc(F)c(C(=O)N6CCOCC6)c(F)c5)c4n3)cc2)CC1

nearest known ligand 0.75

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 14/20 0.75
JAK1 P23458 13/20 0.75
JAK3 P52333 13/20 0.75
TYK2 P29597 12/20 0.75
ALOX5AP P20292 4/20 0.45
FEN1 P39748 4/20 0.45
ABL1 P00519 1/20 0.45
PLAUR Q03405 1/20 0.42
MET P08581 1/20 0.42

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
SCHEMBL2798802 0.85 JAK2 (0.70) JAK2JAK1JAK3TYK2ALOX5AP
SCHEMBL2797461 0.85 JAK2 (1.00) JAK2JAK1JAK3TYK2ABL1
SCHEMBL22511745 0.82 JAK2 (0.90) JAK2JAK1JAK3TYK2ABL1
SCHEMBL2796439 0.79 JAK2 (0.75) JAK2JAK1JAK3TYK2PLAUR
SCHEMBL2798308 0.79 JAK2 (0.81) JAK2JAK1JAK3TYK2ABL1
SCHEMBL2798300 0.79 JAK2 (0.83) JAK2JAK1JAK3TYK2ABL1
SCHEMBL2800299 0.79 JAK2 (0.67) JAK2JAK1JAK3TYK2ALOX5AP
SCHEMBL2797487 0.79 JAK2 (0.72) JAK2JAK1JAK3TYK2ABL1
SCHEMBL3727924 0.78 JAK2 (0.83) JAK2JAK1JAK3TYK2ABL1
SCHEMBL2799842 0.78 JAK2 (0.91) JAK2JAK1JAK3TYK2ALOX5AP

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 9 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
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

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.