SCHEMBL519625

SCHEMBL519625

C[S+]([O-])c1ncc2ccc(-c3cccc(NS(C)(=O)=O)c3)n2n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 3/20 0.48
PTK2 Q05397 2/20 0.48
FYN P06241 8/20 0.45
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
KDM4E B2RXH2 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CYP1A2 P05177 4/20 0.41
CYP3A4 P08684 4/20 0.41
ALDH1A1 P00352 3/20 0.41
CLK4 Q9HAZ1 2/20 0.41
MAPK1 P28482 2/20 0.41
TYRO3 Q06418 1/20 0.41
PIK3CA P42336 2/20 0.40
JAK3 P52333 1/20 0.40
PIK3CD O00329 1/20 0.40
ABL1 P00519 1/20 0.40
EGFR P00533 1/20 0.40
HCK P08631 1/20 0.40
SRC P12931 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
SCHEMBL519903 0.89 JAK2 (0.41) JAK2PTK2FYNBRD4
SCHEMBL519850 0.85 JAK2 (0.38) JAK2PTK2FYNKDR
SCHEMBL520240 0.84 KCNH2 (0.48) JAK2PTK2FYNPIK3CAJAK3
SCHEMBL520973 0.82 JAK2 (0.53) JAK2PTK2FYNNPC1RAB9A
SCHEMBL31108375 0.82 JAK2 (0.51) JAK2PTK2FYNNPC1RAB9A
SCHEMBL25269164 0.82 JAK2 (0.51) JAK2PTK2FYNNPC1RAB9A
SCHEMBL521920 0.81 JAK2 (0.51) JAK2PTK2FYNNPC1RAB9A
SCHEMBL521326 0.81 KDM4E (0.45) FYNNPC1RAB9AKDM4ECYP1A2
SCHEMBL521544 0.80 JAK2 (0.47) JAK2PTK2FYNSMN1; SMN2CYP3A4
SCHEMBL3470162 0.79 CDK9 (0.42) JAK2PTK2FYNNPC1RAB9A

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 JAK2 1/4885PTK2 592/4885FYN 195/4885

“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.