SCHEMBL519559

SCHEMBL519559

c1ccc(Nc2ncc3cc4ccccc4n3n2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 8/20 0.52
INSR P06213 4/20 0.42
JAK2 O60674 4/20 0.42
PTK2 Q05397 2/20 0.42
ALK Q9UM73 2/20 0.42
CDK2 P24941 3/20 0.41
IGF1R P08069 2/20 0.41
PLK3 Q9H4B4 2/20 0.41
CDK1 P06493 2/20 0.41
FGFR1 P11362 2/20 0.41
SRC P12931 2/20 0.41
FGFR3 P22607 2/20 0.41
PLK4 O00444 1/20 0.41
AURKA O14965 1/20 0.41
PDPK1 O15530 1/20 0.41
PRKD3 O94806 1/20 0.41
MAP4K4 O95819 1/20 0.41
NTRK1 P04629 1/20 0.41
LCK P06239 1/20 0.41
FYN P06241 1/20 0.41

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
SCHEMBL520926 0.89 PLK1 (0.42) PLK1INSRJAK2PTK2ALK
SCHEMBL519273 0.87 SYK (0.48) PLK1JAK2CDK2IGF1RKDR
SCHEMBL519515 0.86 PLK1 (0.58) PLK1INSRJAK2PTK2ALK
SCHEMBL519843 0.84 PLK1 (0.62) PLK1JAK2PTK2CDK2IGF1R
SCHEMBL518628 0.82 INSR (0.64) INSRJAK2ALKCDK2IGF1R
SCHEMBL519907 0.81 ALK (0.64) INSRJAK2ALKCDK2FLT3
SCHEMBL519425 0.79 JAK2 (0.48) PLK1JAK2PTK2CDK2CDK1
SCHEMBL519945 0.75 ALK (0.54) INSRJAK2PTK2ALKIGF1R
SCHEMBL10258818 0.73 SLC6A2 (0.36) MEN1CYP1A2TSHRKMT2A
SCHEMBL16542591 0.73 MEN1 (0.36) MEN1TSHRKMT2A

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 PLK1 153/4885INSR 1738/4885JAK2 1/4885

“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.