SCHEMBL519729

SCHEMBL519729

COc1cccc(Nc2ncc3ccc(-c4cccc(Cl)c4)n3n2)c1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 13/20 0.56
INSR P06213 4/20 0.56
ALK Q9UM73 4/20 0.56
PTK2 Q05397 1/20 0.56
PLK1 P53350 1/20 0.54
JAK3 P52333 1/20 0.48
EGFR P00533 1/20 0.48
ERBB3 P21860 1/20 0.48
SYK P43405 1/20 0.44
PIK3CA P42336 1/20 0.44
PIK3CB P42338 1/20 0.44
PIK3CG P48736 1/20 0.44
CDK1 P06493 1/20 0.44
KDR P35968 1/20 0.44
CYP3A4 P08684 1/20 0.43

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
SCHEMBL519495 0.93 JAK2 (0.60) JAK2INSRALKPTK2PLK1
SCHEMBL519875 0.91 JAK2 (0.64) JAK2INSRALKPTK2PLK1
SCHEMBL520994 0.87 JAK2 (0.63) JAK2INSRALKPTK2PLK1
SCHEMBL519808 0.86 JAK2 (0.66) JAK2INSRALKPTK2PLK1
SCHEMBL519696 0.84 JAK2 (0.79) JAK2INSRALKPTK2PLK1
SCHEMBL519619 0.83 JAK2 (0.48) JAK2INSRALKPTK2
SCHEMBL518831 0.82 JAK2 (0.80) JAK2INSRALKPTK2PLK1
SCHEMBL521750 0.80 JAK2 (0.66) JAK2INSRALKPTK2PLK1
SCHEMBL520316 0.80 JAK2 (0.47) JAK2INSRALKPTK2
SCHEMBL519548 0.79 JAK2 (0.67) JAK2INSRALKPTK2JAK3

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-2376491-B1 PYRROLOTRIAZINES AS ALK AND JAK2 INHIBITORS CEPHALON INC (US) 2015-03-04 EP claimed
US-8471005-B2 Pyrrolotriazines as ALK and JAK2 inhibitors CEPHALON, INC. (US) 2013-06-25 US claimed
US-20120028919-A1 PYRROLOTRIAZINES AS ALK AND JAK2 INHIBITORS CEPHALON, INC. (US) 2012-02-02 US claimed
EP-2376491-A1 PYRROLOTRIAZINES AS ALK AND JAK2 INHIBITORS Cephalon, Inc. (US) 2011-10-19 EP claimed
WO-2010071885-A1 PYRROLOTRIAZINES AS ALK AND JAK2 INHIBITORS CEPHALON, INC. (US) 2010-06-24 WO claimed
EP-2376491-B1 PYRROLOTRIAZINES AS ALK AND JAK2 INHIBITORS CEPHALON INC (US) 2015-03-04 EP disclosed
US-8471005-B2 Pyrrolotriazines as ALK and JAK2 inhibitors CEPHALON, INC. (US) 2013-06-25 US disclosed
US-20120028919-A1 PYRROLOTRIAZINES AS ALK AND JAK2 INHIBITORS CEPHALON, INC. (US) 2012-02-02 US disclosed
EP-2376491-A1 PYRROLOTRIAZINES AS ALK AND JAK2 INHIBITORS Cephalon, Inc. (US) 2011-10-19 EP disclosed
WO-2010071885-A1 PYRROLOTRIAZINES AS ALK AND JAK2 INHIBITORS CEPHALON, INC. (US) 2010-06-24 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-20120028919-A1 PYRROLOTRIAZINES AS ALK AND JAK2 INHIBITORS JAK2, ALK, ABL1 JAK2 1/4885INSR 1738/4885ALK 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.