SCHEMBL2800224

SCHEMBL2800224

Cc1cc(-c2cnc3cccc(-c4ccc(C(O)(O)N5CCSCC5)c(F)c4)c3n2)ccc1C(=O)N1CCOCC1

nearest known ligand 0.68

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 13/20 0.68
JAK2 O60674 12/20 0.68
JAK3 P52333 12/20 0.68
TYK2 P29597 12/20 0.68
ALOX5AP P20292 5/20 0.44
FEN1 P39748 5/20 0.44
ATR Q13535 1/20 0.40
PLAUR Q03405 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
SCHEMBL2826310 0.94 JAK2 (0.66) JAK1JAK2JAK3TYK2ALOX5AP
SCHEMBL2798850 0.92 JAK2 (0.71) JAK1JAK2JAK3TYK2ALOX5AP
SCHEMBL2800324 0.92 JAK2 (0.63) JAK1JAK2JAK3TYK2ALOX5AP
SCHEMBL2800853 0.89 JAK2 (0.65) JAK1JAK2JAK3TYK2PLAUR
SCHEMBL2797785 0.88 JAK2 (0.51) JAK1JAK2JAK3TYK2ATR
SCHEMBL2802325 0.86 JAK2 (0.60) JAK1JAK2JAK3TYK2
SCHEMBL2800388 0.85 JAK2 (0.54) JAK1JAK2JAK3TYK2
SCHEMBL2800367 0.84 JAK2 (0.60) JAK1JAK2JAK3TYK2ALOX5AP
SCHEMBL2798450 0.82 JAK2 (0.57) JAK1JAK2JAK3TYK2ATR
SCHEMBL2798298 0.81 JAK2 (1.00) JAK1JAK2JAK3TYK2ALOX5AP

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 5 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-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 JAK1 2/4885JAK2 1/4885JAK3 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.