SCHEMBL521661

SCHEMBL521661

CC(=O)N1CCc2ccc(Nc3ncc4ccc(-c5cccc(NC(=O)C(C)(C)C)c5)n4n3)cc21

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 14/20 0.47
INSR P06213 3/20 0.46
ALK Q9UM73 2/20 0.46
PTK2 Q05397 5/20 0.46
EGFR P00533 1/20 0.42
CHEK1 O14757 1/20 0.42
FLT3 P36888 1/20 0.42
BRD4 O60885 1/20 0.41
TYK2 P29597 1/20 0.39

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
SCHEMBL521007 0.87 JAK2 (0.59) JAK2INSRALKPTK2EGFR
SCHEMBL521567 0.85 JAK2 (0.48) JAK2INSRALKPTK2EGFR
SCHEMBL521812 0.84 JAK2 (0.67) JAK2INSRALKPTK2EGFR
SCHEMBL521130 0.83 DYRK3 (0.52) JAK2INSRALKPTK2
SCHEMBL520409 0.82 JAK2 (0.57) JAK2INSRALKPTK2
SCHEMBL16530441 0.81 INSR (0.47) JAK2INSRALKPTK2EGFR
SCHEMBL521334 0.81 EGFR (0.49) JAK2INSRALKEGFRCHEK1
SCHEMBL520688 0.78 JAK2 (0.48) JAK2INSRALKPTK2EGFR
SCHEMBL522554 0.78 JAK2 (0.48) JAK2INSRALKPTK2EGFR
SCHEMBL16530444 0.77 INSR (0.45) JAK2INSRALKPTK2EGFR

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 8 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-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.