SCHEMBL521571

SCHEMBL521571

Cc1cc(-c2ccccc2N(C)S(C)(=O)=O)n2nc(O)ncc12

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 10/20 0.53
PTK2 Q05397 3/20 0.53
ALK Q9UM73 10/20 0.49
NPM1 P06748 5/20 0.49
INSR P06213 3/20 0.43
JAK3 P52333 1/20 0.43
CYP3A4 P08684 1/20 0.39
ALOX5AP P20292 1/20 0.38
FEN1 P39748 1/20 0.38
POLB P06746 1/20 0.35

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
SCHEMBL522655 0.88 JAK2 (0.53) JAK2PTK2ALKNPM1INSR
SCHEMBL519742 0.81 ALK (0.56) JAK2PTK2ALKNPM1INSR
SCHEMBL521136 0.80 JAK2 (0.39) JAK2PTK2ALKNPM1INSR
SCHEMBL520719 0.79 ALK (0.41) JAK2PTK2ALKNPM1INSR
SCHEMBL520690 0.73 JAK2 (0.42) JAK2PTK2ALKNPM1INSR
SCHEMBL521048 0.73 JAK2 (0.52) JAK2PTK2ALKNPM1INSR
SCHEMBL522173 0.72 JAK2 (0.49) JAK2PTK2ALKNPM1INSR
SCHEMBL522157 0.71 ALK (0.43) JAK2PTK2ALKNPM1INSR
SCHEMBL520325 0.70 ALK (0.79) JAK2PTK2ALKNPM1INSR
SCHEMBL519833 0.67 JAK2 (0.45) JAK2PTK2ALKNPM1INSR

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 592/4885ALK 2/4885

“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.