SCHEMBL520557

SCHEMBL520557

CC(C)(C)OC(=O)N1CCCC1COc1cc(N)ccc1Cl

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 3/20 0.47
FEN1 P39748 1/20 0.47
DPP4 P27487 1/20 0.46
ALDH1A1 P00352 2/20 0.45
F2RL3 Q96RI0 4/20 0.42
NR1H2 P55055 1/20 0.42
OPRK1 P41145 1/20 0.41
LMNA P02545 2/20 0.40
TSHR P16473 2/20 0.40
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
GPR119 Q8TDV5 2/20 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
SCHEMBL521653 1.00 ALOX5AP (0.47) ALOX5APFEN1DPP4ALDH1A1F2RL3
SCHEMBL520556 1.00 ALOX5AP (0.47) ALOX5APFEN1DPP4ALDH1A1F2RL3
SCHEMBL448828 0.88 ALOX5AP (0.47) ALOX5APFEN1DPP4F2RL3NR1H2
SCHEMBL448827 0.88 ALOX5AP (0.47) ALOX5APFEN1DPP4F2RL3NR1H2
SCHEMBL4367186 0.86 ALOX5AP (0.48) ALOX5APFEN1F2RL3NR1H2GPR119
SCHEMBL4372549 0.86 ALOX5AP (0.48) ALOX5APFEN1F2RL3NR1H2GPR119
SCHEMBL13419700 0.85 ALOX5AP (0.51) ALOX5APFEN1F2RL3NR1H2OPRK1
SCHEMBL29007980 0.85 DPP4 (0.48) ALOX5APFEN1DPP4ALDH1A1F2RL3
SCHEMBL4533897 0.85 DPP4 (0.50) DPP4
SCHEMBL4371497 0.84 ALOX5AP (0.45) ALOX5APFEN1DPP4ALDH1A1F2RL3

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 ALOX5AP 2284/4885FEN1 4025/4885DPP4 1468/4885

“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.