SCHEMBL520552

SCHEMBL520552

CSc1ncc2ccc(-c3cccc(NCCS(C)(=O)=O)c3)n2n1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 11/20 0.41
PTK2 Q05397 6/20 0.41
FYN P06241 7/20 0.37
INSR P06213 1/20 0.36
ALK Q9UM73 1/20 0.36
PDE4D Q08499 1/20 0.34
FGFR3 P22607 1/20 0.33
KDR P35968 1/20 0.33

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
SCHEMBL521920 0.84 JAK2 (0.51) JAK2PTK2FYN
SCHEMBL520881 0.84 INSR (0.41) JAK2PTK2FYNINSRALK
SCHEMBL519850 0.82 JAK2 (0.38) JAK2PTK2FYNINSRALK
SCHEMBL521743 0.78 JAK2 (0.49) JAK2PTK2FYNINSRALK
SCHEMBL522170 0.77 JAK2 (0.41) JAK2PTK2INSRALKKDR
SCHEMBL522199 0.77 DYRK3 (0.44) JAK2PTK2FYNINSRALK
SCHEMBL521447 0.76 JAK2 (0.41) JAK2PTK2INSRALK
SCHEMBL15048632 0.76 JAK2 (0.36) JAK2PTK2FYNINSRALK
SCHEMBL520639 0.76 KDM4E (0.46) JAK2PTK2FYN
SCHEMBL522032 0.75 JAK2 (0.59) JAK2PTK2INSRALK

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-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 1/4885PTK2 592/4885FYN 195/4885

“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.