SCHEMBL2484576

SCHEMBL2484576

COc1ccccc1-c1ccc2cnc(OS(C)(=O)=O)nn12

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 11/20 0.53
ALK Q9UM73 9/20 0.46
INSR P06213 6/20 0.46
CYP3A4 P08684 1/20 0.46
NPM1 P06748 6/20 0.44
PTK2 Q05397 1/20 0.41
MAPT P10636 1/20 0.40

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
SCHEMBL520634 0.86 JAK2 (0.50) JAK2ALKINSRCYP3A4NPM1
SCHEMBL521498 0.82 JAK2 (0.55) JAK2ALKINSRCYP3A4NPM1
SCHEMBL2502680 0.81 ALK (0.54) JAK2ALKINSRCYP3A4NPM1
SCHEMBL2502679 0.80 ALK (0.41) JAK2ALKINSRCYP3A4NPM1
SCHEMBL17577024 0.78 JAK2 (0.60) JAK2ALKINSRCYP3A4NPM1
SCHEMBL2509986 0.77 JAK2 (0.47) JAK2PTK2
SCHEMBL519921 0.77 JAK2 (0.59) JAK2ALKINSRCYP3A4NPM1
SCHEMBL520547 0.77 JAK2 (0.59) JAK2ALKINSRCYP3A4NPM1
SCHEMBL521729 0.76 JAK2 (0.52) JAK2ALKINSRCYP3A4NPM1
SCHEMBL522266 0.75 JAK2 (0.55) JAK2ALKINSRCYP3A4NPM1

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 disclosed
WO-2010071885-A1 PYRROLOTRIAZINES AS ALK AND JAK2 INHIBITORS CEPHALON, INC. (US) 2010-06-24 WO disclosed