SCHEMBL521496

SCHEMBL521496

CN1CCC(c2ccc(Nc3ncc4ccc(-c5ccn(C)n5)n4n3)cc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 18/20 0.54
PTK2 Q05397 11/20 0.54
INSR P06213 3/20 0.54
ALK Q9UM73 3/20 0.54
NPM1 P06748 1/20 0.54
CYP3A4 P08684 1/20 0.48

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
SCHEMBL3477763 0.94 JAK2 (0.50) JAK2PTK2INSRALKNPM1
SCHEMBL521674 0.83 INSR (0.59) JAK2PTK2INSRALKNPM1
SCHEMBL520502 0.83 INSR (0.50) JAK2PTK2INSRALKNPM1
SCHEMBL522212 0.81 ALK (0.80) JAK2PTK2INSRALKNPM1
SCHEMBL521751 0.81 JAK2 (0.76) JAK2PTK2INSRALK
SCHEMBL521803 0.81 JAK2 (0.76) JAK2PTK2INSRALKNPM1
SCHEMBL521663 0.81 JAK2 (0.58) JAK2PTK2INSRALKNPM1
SCHEMBL519444 0.79 JAK2 (0.59) JAK2PTK2INSRALKNPM1
SCHEMBL521980 0.79 ALK (0.66) JAK2PTK2INSRALKNPM1
SCHEMBL521029 0.79 JAK2 (0.64) JAK2PTK2INSRALKNPM1

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 6 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-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 JAK2 1/4885PTK2 592/4885INSR 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.