SCHEMBL520502

SCHEMBL520502

CN1CCC(c2ccc(Nc3ncc4ccc(Br)n4n3)cc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
INSR P06213 2/20 0.50
ALK Q9UM73 2/20 0.50
NPM1 P06748 1/20 0.50
JAK2 O60674 9/20 0.49
PTK2 Q05397 5/20 0.48
TTK P33981 1/20 0.47
MAP4K1 Q92918 7/20 0.47
MAP4K3 Q8IVH8 1/20 0.47
KIT P10721 1/20 0.46
FLT3 P36888 1/20 0.46

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 0.90 JAK2 (0.50) INSRALKNPM1JAK2PTK2
SCHEMBL522163 0.85 JAK2 (0.53) JAK2PTK2
SCHEMBL521496 0.83 JAK2 (0.54) INSRALKNPM1JAK2PTK2
SCHEMBL519201 0.81 JAK2 (0.74) INSRALKNPM1JAK2PTK2
SCHEMBL519959 0.81 ALK (0.69) INSRALKNPM1JAK2
SCHEMBL15048636 0.80 JAK2 (0.59) INSRALKNPM1JAK2PTK2
SCHEMBL521674 0.80 INSR (0.59) INSRALKNPM1JAK2PTK2
SCHEMBL15048650 0.80 JAK2 (0.59) INSRALKNPM1JAK2PTK2
SCHEMBL522212 0.79 ALK (0.80) INSRALKNPM1JAK2PTK2
SCHEMBL521663 0.78 JAK2 (0.58) INSRALKNPM1JAK2PTK2

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 INSR 1738/4885ALK 2/4885NPM1 1309/4885

“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.