SCHEMBL521950

SCHEMBL521950

CCN1CCOC(c2ccc(Nc3ncc4ccc(-c5cnn(C)c5)n4n3)cc2)C1

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
INSR P06213 3/20 0.44
JAK2 O60674 16/20 0.44
PTK2 Q05397 10/20 0.44
ALK Q9UM73 2/20 0.44
EGFR P00533 1/20 0.40

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
SCHEMBL520539 0.82 JAK2 (0.63) INSRJAK2PTK2ALK
SCHEMBL519777 0.81 JAK2 (0.65) INSRJAK2PTK2ALK
SCHEMBL16530368 0.80 JAK2 (0.52) INSRJAK2PTK2ALK
SCHEMBL519568 0.80 JAK2 (0.51) INSRJAK2PTK2ALK
SCHEMBL520501 0.79 JAK2 (0.67) INSRJAK2PTK2
SCHEMBL520638 0.77 JAK2 (0.66) INSRJAK2PTK2ALK
SCHEMBL520342 0.77 JAK2 (0.64) INSRJAK2PTK2ALK
SCHEMBL519785 0.76 INSR (0.74) INSRJAK2ALK
SCHEMBL519692 0.73 ALK (0.77) INSRJAK2ALKEGFR
SCHEMBL522001 0.73 ALK (0.61) INSRJAK2ALKEGFR

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 4 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 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

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 INSR 1738/4885JAK2 1/4885PTK2 592/4885

“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.