SCHEMBL520034

SCHEMBL520034

COc1cc(N2CCC(N3CCN(C)CC3)CC2)ccc1Nc1ncc2ccc(-c3ccccc3S(=O)(=O)N(C)C)n2n1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 17/20 0.68
INSR P06213 14/20 0.68
NPM1 P06748 11/20 0.68
IGF1R P08069 4/20 0.66
JAK2 O60674 3/20 0.55
KCNH2 Q12809 1/20 0.55
EGFR P00533 3/20 0.55
BMPR1B O00238 2/20 0.55
PLK4 O00444 2/20 0.55
GAK O14976 2/20 0.55
ERN1 O75460 2/20 0.55
STK10 O94804 2/20 0.55
ABL1 P00519 2/20 0.55
LCK P06239 2/20 0.55
FYN P06241 2/20 0.55
FES P07332 2/20 0.55
YES1 P07947 2/20 0.55
HCK P08631 2/20 0.55
ROS1 P08922 2/20 0.55
FER P16591 2/20 0.55

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
SCHEMBL519150 0.94 ALK (0.78) ALKINSRNPM1IGF1RJAK2
SCHEMBL520672 0.89 ALK (0.85) ALKINSRNPM1IGF1RJAK2
SCHEMBL519737 0.86 ALK (0.81) ALKINSRNPM1IGF1RJAK2
SCHEMBL519890 0.86 ALK (0.80) ALKINSRNPM1IGF1RJAK2
SCHEMBL518909 0.86 ALK (0.85) ALKINSRNPM1IGF1RJAK2
SCHEMBL520519 0.86 ALK (0.83) ALKINSRNPM1JAK2KCNH2
SCHEMBL521341 0.84 ALK (0.72) ALKINSRNPM1IGF1RJAK2
SCHEMBL16530443 0.84 ALK (0.71) ALKINSRNPM1JAK2KCNH2
SCHEMBL520286 0.83 ALK (0.80) ALKINSRNPM1IGF1RJAK2
SCHEMBL521066 0.83 ALK (0.83) ALKINSRNPM1JAK2KCNH2

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 10 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 claimed
US-8471005-B2 Pyrrolotriazines as ALK and JAK2 inhibitors CEPHALON, INC. (US) 2013-06-25 US claimed
US-20120028919-A1 PYRROLOTRIAZINES AS ALK AND JAK2 INHIBITORS CEPHALON, INC. (US) 2012-02-02 US claimed
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
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 2/4885INSR 1738/4885NPM1 1309/4885

“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.