SCHEMBL520352

SCHEMBL520352

COc1cc(N2CCC(N3CCN(C)CC3)CC2)ccc1Nc1ncc2cc3ccccc3n2n1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
INSR P06213 14/20 0.64
ALK Q9UM73 14/20 0.64
IGF1R P08069 12/20 0.64
NPM1 P06748 2/20 0.61
LRRK2 Q5S007 2/20 0.58
MAPK7 Q13164 1/20 0.58
EGFR P00533 5/20 0.57
PTK2 Q05397 2/20 0.57
CHEK1 O14757 1/20 0.57
AURKA O14965 1/20 0.57
NUAK1 O60285 1/20 0.57
JAK2 O60674 1/20 0.57
STK10 O94804 1/20 0.57
PRKD3 O94806 1/20 0.57
SLC34A2 O95436 1/20 0.57
CHEK2 O96017 1/20 0.57
ABL1 P00519 1/20 0.57
CD74 P04233 1/20 0.57
ERBB2 P04626 1/20 0.57
LCK P06239 1/20 0.57

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
SCHEMBL2506200 0.93 INSR (0.56) INSRALKIGF1RNPM1LRRK2
SCHEMBL519778 0.92 ALK (0.70) INSRALKIGF1RNPM1LRRK2
SCHEMBL519945 0.86 ALK (0.54) INSRALKIGF1REGFRPTK2
SCHEMBL519952 0.84 INSR (0.64) INSRALKIGF1RNPM1LRRK2
SCHEMBL520672 0.84 ALK (0.85) INSRALKIGF1RNPM1LRRK2
SCHEMBL520040 0.84 ALK (0.63) INSRALKIGF1RNPM1LRRK2
SCHEMBL519890 0.82 ALK (0.80) INSRALKIGF1RNPM1LRRK2
SCHEMBL518909 0.81 ALK (0.85) INSRALKIGF1RNPM1LRRK2
SCHEMBL18912630 0.80 INSR (0.68) INSRALKIGF1RLRRK2MAPK7
SCHEMBL521341 0.80 ALK (0.72) INSRALKIGF1RNPM1LRRK2

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 INSR 1738/4885ALK 2/4885IGF1R 1028/4885

“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.