SCHEMBL520135

SCHEMBL520135

COc1cccc(-c2ccn3nc(Nc4ccc(N5CCN(C)CC5)cc4)ncc23)c1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 9/20 0.57
AURKA O14965 1/20 0.57
CDK4 P11802 1/20 0.57
BRD4 O60885 4/20 0.56
MAPKAPK2 P49137 1/20 0.53
PTK2 Q05397 5/20 0.53
FGFR4 P22455 1/20 0.52
EGFR P00533 1/20 0.51
LCK P06239 1/20 0.49
SRC P12931 1/20 0.49
KDR P35968 1/20 0.49
INSR P06213 2/20 0.49
ALK Q9UM73 2/20 0.49
CYP3A4 P08684 1/20 0.49
JAK3 P52333 2/20 0.48
MAP4K1 Q92918 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
SCHEMBL520475 0.89 JAK2 (0.53) JAK2AURKACDK4BRD4PTK2
SCHEMBL520236 0.87 FYN (0.54) JAK2CDK4BRD4PTK2FGFR4
SCHEMBL519531 0.86 ALK (0.60) JAK2AURKACDK4PTK2FGFR4
SCHEMBL520471 0.82 JAK2 (0.67) JAK2CDK4PTK2FGFR4LCK
SCHEMBL520244 0.81 CDK4 (0.53) JAK2CDK4MAPKAPK2PTK2EGFR
SCHEMBL520453 0.79 ALK (0.75) JAK2AURKACDK4BRD4INSR
SCHEMBL519267 0.78 ALK (0.56) JAK2AURKACDK4PTK2FGFR4
SCHEMBL5472158 0.73 VCP (0.67) JAK2AURKACDK4BRD4MAPKAPK2
SCHEMBL3203847 0.73 JAK2 (1.00) JAK2AURKACDK4BRD4MAPKAPK2
SCHEMBL520924 0.72 JAK2 (0.70) JAK2CDK4BRD4PTK2FGFR4

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 8 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
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
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 1/4885AURKA 451/4885CDK4 31/4885

“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.