SCHEMBL520611

SCHEMBL520611

CN1CCN(c2cccc(Nc3ncc4ccc(Br)n4n3)c2)CC1

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 12/20 0.67
ALK Q9UM73 8/20 0.56
INSR P06213 6/20 0.56
JAK3 P52333 3/20 0.52
JAK1 P23458 1/20 0.52
CYP3A4 P08684 1/20 0.52
NPM1 P06748 2/20 0.49
AURKA O14965 1/20 0.49
CDK2 P24941 1/20 0.49
PTK2 Q05397 2/20 0.48
BRD4 O60885 1/20 0.47

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
SCHEMBL519830 0.87 JAK2 (0.66) JAK2INSRJAK3JAK1CDK2
SCHEMBL519959 0.86 ALK (0.69) JAK2ALKINSRCYP3A4NPM1
SCHEMBL520571 0.82 JAK2 (0.68) JAK2ALKINSRJAK3CYP3A4
SCHEMBL519548 0.81 JAK2 (0.67) JAK2ALKINSRJAK3CYP3A4
SCHEMBL520723 0.81 JAK2 (0.59) JAK2ALKINSRJAK3JAK1
SCHEMBL521344 0.80 JAK2 (0.68) JAK2ALKINSRCYP3A4NPM1
SCHEMBL519866 0.80 JAK2 (1.00) JAK2ALKINSRJAK3CYP3A4
SCHEMBL520488 0.80 JAK2 (0.69) JAK2ALKINSRJAK3CYP3A4
SCHEMBL519520 0.79 ALK (0.73) JAK2ALKINSRCYP3A4NPM1
SCHEMBL521870 0.79 JAK2 (0.57) JAK2ALKINSRJAK3JAK1

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 1/4885ALK 2/4885INSR 1738/4885

“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.