SCHEMBL520595

SCHEMBL520595

COc1ccc(Cl)cc1-c1ccc2cnc(Nc3cccc(C(=O)N4CCOCC4)c3)nn12

nearest known ligand 0.70

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 11/20 0.70
INSR P06213 2/20 0.47
ALK Q9UM73 2/20 0.47
CYP3A4 P08684 1/20 0.47
LRRK2 Q5S007 4/20 0.47
ALDH1A1 P00352 1/20 0.47
POLB P06746 1/20 0.47
GAA P10253 1/20 0.47
MAPK1 P28482 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
NPM1 P06748 1/20 0.46
NTRK1 P04629 1/20 0.46
MAP3K9 P80192 1/20 0.45
MKNK2 Q9HBH9 1/20 0.45
PTK2 Q05397 1/20 0.45
IGF1R P08069 1/20 0.44
KCNH2 Q12809 1/20 0.44

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
SCHEMBL520095 0.92 JAK2 (0.80) JAK2INSRALKCYP3A4LRRK2
SCHEMBL520006 0.91 JAK2 (0.59) JAK2INSRALKCYP3A4NPM1
SCHEMBL520060 0.90 JAK2 (0.83) JAK2INSRALKCYP3A4ALDH1A1
SCHEMBL520604 0.85 JAK2 (0.55) JAK2INSRCYP3A4ALDH1A1SMN1; SMN2
SCHEMBL519003 0.85 JAK2 (0.52) JAK2INSRALKCYP3A4NPM1
SCHEMBL2507452 0.84 JAK2 (0.72) JAK2INSRALKCYP3A4ALDH1A1
SCHEMBL520374 0.83 JAK2 (0.66) JAK2INSRALKCYP3A4NPM1
SCHEMBL520261 0.83 JAK2 (1.00) JAK2INSRALKCYP3A4ALDH1A1
SCHEMBL520275 0.82 JAK2 (0.78) JAK2INSRALKCYP3A4NPM1
SCHEMBL519953 0.81 JAK2 (0.71) JAK2INSRALKCYP3A4NPM1

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.