SCHEMBL521077

SCHEMBL521077

CN1CCN(c2cccc(Nc3ncc4ccc(-c5cnn(C(C(N)=O)N(c6cccc(N7CCN(C)CC7)c6)c6ncc7ccc(-c8cn[nH]c8)n7n6)c5)n4n3)c2)CC1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 11/20 0.48
ALK Q9UM73 8/20 0.43
INSR P06213 6/20 0.43
EGFR P00533 1/20 0.40
CYP3A4 P08684 2/20 0.39
JAK3 P52333 1/20 0.38
PTK2 Q05397 1/20 0.38
NPM1 P06748 1/20 0.37
CDK2 P24941 2/20 0.37
AURKA O14965 1/20 0.37
CCNA2 P20248 1/20 0.37
CCNA1 P78396 1/20 0.37

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
SCHEMBL521262 0.85 JAK2 (0.49) JAK2ALKINSREGFRCYP3A4
SCHEMBL520488 0.81 JAK2 (0.69) JAK2ALKINSRCYP3A4JAK3
SCHEMBL521333 0.75 JAK2 (0.58) JAK2ALKINSREGFRCYP3A4
SCHEMBL520571 0.75 JAK2 (0.68) JAK2ALKINSREGFRCYP3A4
SCHEMBL519755 0.72 JAK2 (0.61) JAK2ALKINSRCYP3A4JAK3
SCHEMBL524289 0.72 JAK2 (0.40) JAK2ALKINSREGFRCYP3A4
SCHEMBL521642 0.71 JAK2 (0.62) JAK2ALKINSRCYP3A4JAK3
SCHEMBL521372 0.71 JAK2 (0.62) JAK2ALKINSRCYP3A4NPM1
SCHEMBL520741 0.71 JAK2 (0.67) JAK2ALKINSREGFRCYP3A4
SCHEMBL3469471 0.70 JAK2 (0.49) JAK2ALKINSREGFRCYP3A4

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.