SCHEMBL2802013

SCHEMBL2802013

CC(C)(C)OC(=O)N1CCN(c2cccc(-c3cnc4cccc(-c5cc(F)c(C(O)(O)N6CCSCC6)c(F)c5)c4n3)c2)CC1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 6/20 0.42
JAK3 P52333 6/20 0.42
JAK1 P23458 4/20 0.42
TYK2 P29597 4/20 0.42
ADORA2A P29274 1/20 0.40
ATR Q13535 2/20 0.38
CKS1B P61024 2/20 0.37
SKP1 P63208 2/20 0.37
SKP2 Q13309 2/20 0.37
PDK2 Q15119 1/20 0.37
GBA1 P04062 1/20 0.37
PTK2 Q05397 1/20 0.37
PDE4D Q08499 1/20 0.37
KIT P10721 1/20 0.36
ALK Q9UM73 1/20 0.36
PIK3CA P42336 1/20 0.36
MET P08581 1/20 0.35
VCP P55072 1/20 0.35
GPR119 Q8TDV5 1/20 0.35

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
SCHEMBL2797789 0.87 JAK2 (0.53) JAK2JAK3JAK1TYK2MET
SCHEMBL2800285 0.84 JAK2 (0.42) JAK2JAK3JAK1TYK2
SCHEMBL2800394 0.81 JAK2 (0.46) JAK2JAK3JAK1TYK2ADORA2A
SCHEMBL2802016 0.81 JAK2 (0.55) JAK2JAK3JAK1TYK2ADORA2A
SCHEMBL2802011 0.81 JAK2 (0.62) JAK2JAK3JAK1TYK2ADORA2A
SCHEMBL2800460 0.78 JAK2 (0.62) JAK2JAK3JAK1TYK2ATR
SCHEMBL2801044 0.78 JAK2 (0.47) JAK2JAK3JAK1TYK2MET
SCHEMBL2800964 0.78 ADORA2A (0.48) JAK2JAK3ADORA2AATRCKS1B
SCHEMBL2799458 0.78 JAK2 (0.41) JAK2JAK3JAK1TYK2
SCHEMBL2802198 0.77 JAK2 (0.44) JAK2JAK3JAK1TYK2

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 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
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 1/4885JAK3 3/4885JAK1 2/4885

“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.