SCHEMBL520246

SCHEMBL520246

C[S+]([O-])c1ncc2ccc(-c3ccccc3S(C)(=O)=O)n2n1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 11/20 0.51
JAK2 O60674 9/20 0.39
INSR P06213 6/20 0.38
CYP3A4 P08684 2/20 0.37
HSD11B1 P28845 1/20 0.34
NPM1 P06748 3/20 0.33
ALOX5AP P20292 2/20 0.33
FEN1 P39748 2/20 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
SCHEMBL520429 0.84 ALK (0.37) ALKJAK2INSRCYP3A4
SCHEMBL520428 0.83 JAK2 (0.37) ALKJAK2INSRCYP3A4NPM1
SCHEMBL520253 0.83 ALK (0.53) ALKJAK2INSRCYP3A4NPM1
SCHEMBL519693 0.82 ALK (0.53) ALKJAK2INSRCYP3A4NPM1
SCHEMBL521052 0.81 JAK2 (0.38) ALKJAK2INSRCYP3A4NPM1
SCHEMBL521518 0.80 EGLN2 (0.39) ALKJAK2INSRCYP3A4HSD11B1
SCHEMBL520010 0.80 FYN (0.40) ALKJAK2INSRCYP3A4NPM1
SCHEMBL521474 0.80 EGLN2 (0.39) ALKJAK2INSRCYP3A4NPM1
SCHEMBL526559 0.80 JAK2 (0.37) ALKJAK2INSRCYP3A4
SCHEMBL521380 0.79 ALK (0.41) ALKJAK2INSRCYP3A4NPM1

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 ALK 2/4885JAK2 1/4885INSR 1738/4885

“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.