SCHEMBL519978

SCHEMBL519978

CSc1ncc2ccc(-c3ccccc3O)n2n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.44
FYN P06241 1/20 0.42
IDO1 P14902 3/20 0.40
JAK2 O60674 8/20 0.39
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
MAPT P10636 2/20 0.34
HPGD P15428 2/20 0.34
POLB P06746 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
ALK Q9UM73 7/20 0.34
INSR P06213 4/20 0.34
NPM1 P06748 2/20 0.34
CYP3A4 P08684 1/20 0.34
PTK2 Q05397 2/20 0.33
MEN1 O00255 1/20 0.33
RECQL P46063 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL520259 0.83 EGLN2 (0.40) JAK2KDM4EALDH1A1MAPTHPGD
SCHEMBL521590 0.83 EGLN2 (0.40) JAK2KDM4EALDH1A1MAPTHPGD
SCHEMBL521486 0.83 JAK2 (0.39) JAK2KDM4EALDH1A1MAPTHPGD
SCHEMBL520446 0.82 JAK2 (0.57) JAK2ALKINSRNPM1CYP3A4
SCHEMBL520503 0.82 INSR (0.42) JAK2KDM4EALDH1A1MAPTHPGD
SCHEMBL521115 0.80 ALK (0.41) JAK2KDM4EALDH1A1MAPTHPGD
SCHEMBL521852 0.80 AURKA (0.42) MAPK1JAK2KDM4EALDH1A1HPGD
SCHEMBL519714 0.80 KDM4E (0.52) FYNJAK2KDM4EALDH1A1MAPT
SCHEMBL519998 0.79 ABCG2 (0.40) JAK2KDM4EALDH1A1MAPTHPGD
SCHEMBL522645 0.78 JAK2 (0.45) JAK2ALKINSRNPM1CYP3A4

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 MAPK1 264/4885FYN 195/4885IDO1 588/4885

“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.