SCHEMBL2800285

SCHEMBL2800285

OC(O)(c1c(F)cc(-c2cccc3ncc(-c4cccc(N5CCNCC5)c4)nc23)cc1F)N1CCSCC1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 6/20 0.42
JAK1 P23458 5/20 0.42
TYK2 P29597 5/20 0.42
JAK3 P52333 5/20 0.42
ABL1 P00519 1/20 0.40
HTR7 P34969 5/20 0.39
HTR1A P08908 4/20 0.39
PRKCI P41743 1/20 0.38
KARS1 Q15046 2/20 0.37
CDK1 P06493 2/20 0.36
CDK2 P24941 2/20 0.36
MKNK1 Q9BUB5 2/20 0.36
MKNK2 Q9HBH9 2/20 0.36
TGFBR1 P36897 1/20 0.35
ACVR1 Q04771 1/20 0.35
KDM4E B2RXH2 1/20 0.35
CHRNB2 P17787 1/20 0.35
CHRNA4 P43681 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 0.90 JAK2 (0.53) JAK2JAK1TYK2JAK3ABL1
SCHEMBL2802013 0.84 JAK2 (0.42) JAK2JAK1TYK2JAK3
SCHEMBL2798305 0.83 JAK2 (0.62) JAK2JAK1TYK2JAK3ACVR1
SCHEMBL2798896 0.81 JAK2 (0.63) JAK2JAK1TYK2JAK3ABL1
SCHEMBL2799458 0.80 JAK2 (0.41) JAK2JAK1TYK2JAK3ABL1
SCHEMBL2800394 0.79 JAK2 (0.46) JAK2JAK1TYK2JAK3KDM4E
SCHEMBL2800460 0.78 JAK2 (0.62) JAK2JAK1TYK2JAK3
SCHEMBL2800283 0.76 JAK3 (0.57) JAK2JAK1TYK2JAK3ABL1
SCHEMBL2799307 0.76 JAK2 (0.44) JAK2JAK1TYK2JAK3ABL1
SCHEMBL2800367 0.75 JAK2 (0.60) JAK2JAK1TYK2JAK3KDM4E

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 JAK2 1/4885JAK1 2/4885TYK2 4/4885

“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.