SCHEMBL2487124

SCHEMBL2487124

CCCS(=O)(=O)c1cccc(-c2ccc3cnc(Nc4ccc(Cl)c(OC[C@H]5CCCN5)c4)nn23)c1

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 17/20 0.47
PTK2 Q05397 7/20 0.45
INSR P06213 4/20 0.39
ALK Q9UM73 3/20 0.39

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
SCHEMBL521354 0.92 JAK2 (0.53) JAK2PTK2INSRALK
SCHEMBL521985 0.92 JAK2 (0.53) JAK2PTK2INSRALK
SCHEMBL521353 0.92 JAK2 (0.53) JAK2PTK2INSRALK
SCHEMBL521566 0.90 JAK2 (0.47) JAK2PTK2INSRALK
SCHEMBL521565 0.90 JAK2 (0.47) JAK2PTK2INSRALK
SCHEMBL521806 0.90 JAK2 (0.47) JAK2PTK2INSRALK
SCHEMBL521713 0.78 JAK2 (0.55) JAK2PTK2INSRALK
SCHEMBL521714 0.78 JAK2 (0.51) JAK2PTK2INSRALK
SCHEMBL519670 0.76 JAK2 (0.65) JAK2PTK2INSRALK
SCHEMBL519671 0.75 JAK2 (0.60) JAK2PTK2INSRALK

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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