SCHEMBL1601602

SCHEMBL1601602

O=C(NC1CCc2ccccc21)c1cc[c]cc1

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.66
LMNA P02545 3/20 0.60
KMT2A Q03164 2/20 0.60
ALDH1A1 P00352 6/20 0.60
L3MBTL1 Q9Y468 1/20 0.60
PDE4A P27815 1/20 0.58
PDE4B Q07343 1/20 0.58
PDE4C Q08493 1/20 0.58
PDE4D Q08499 1/20 0.58
TAS1R3 Q7RTX0 7/20 0.56
TAS1R1 Q7RTX1 7/20 0.56
KDM4E B2RXH2 1/20 0.56
MEN1 O00255 1/20 0.55
TAS1R2 Q8TE23 3/20 0.54
TSHR P16473 1/20 0.53
CYP2D6 P10635 1/20 0.52

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
SCHEMBL3460628 0.88 HTT (0.83) HTTLMNAKMT2AALDH1A1L3MBTL1
SCHEMBL29742388 0.88 HTT (0.83) HTTLMNAKMT2AALDH1A1L3MBTL1
SCHEMBL3459886 0.88 HTT (0.83) HTTLMNAKMT2AALDH1A1L3MBTL1
SCHEMBL2465110 0.88 HTT (0.83) HTTLMNAKMT2AALDH1A1L3MBTL1
SCHEMBL4500500 0.85 HTT (0.61) HTTLMNAKMT2AALDH1A1L3MBTL1
SCHEMBL4626769 0.85 HTT (0.58) HTTLMNAKMT2AALDH1A1L3MBTL1
SCHEMBL6570868 0.84 LMNA (0.69) HTTLMNAKMT2AALDH1A1L3MBTL1
SCHEMBL8160654 0.83 HTT (0.70) HTTLMNAKMT2AALDH1A1L3MBTL1
SCHEMBL10528660 0.83 HTT (0.66) HTTLMNAKMT2AALDH1A1L3MBTL1
SCHEMBL19630401 0.83 HTT (0.66) HTTLMNAKMT2AALDH1A1L3MBTL1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2091951-B1 PYRIDO[2,3-B]PYRAZINE AND [1,8]-NAPHTHYRIDINE DERIVATIVES AS ALK AND C-MET INHIBITORS CEPHALON INC (US) 2018-02-28 EP disclosed
US-8080561-B2 Pyridopyrazines and derivatives thereof as ALK and c-Met inhibitors CEPHALON, INC. (US) 2011-12-20 US disclosed
US-20110160204-A1 PYRIDOPYRAZINES AND DERIVATIVES THEREOF AS ALK AND c-MET INHIBITORS CEPHALON, INC. (US) 2011-06-30 US disclosed
US-7919502-B2 Pyridopyrazines and derivatives thereof as ALK and c-MET inhibitors CEPHALON, INC. (US) 2011-04-05 US disclosed
US-20100048576-A1 PYRIDOPYRAZINES AND DERIVATIVES THEREOF AS ALK AND c-MET INHIBITORS CEPHALON, INC. (US) 2010-02-25 US disclosed
US-7601716-B2 Pyridopyrazines and derivatives thereof as ALK and c-Met inhibitors CEPHALON, INC. (US) 2009-10-13 US disclosed
EP-2091951-A2 PYRIDO[2,3-B]PYRAZINE AND[1,8]-NAPHTYRIDINE DERIVATIVES AS ALK AND C-MET INHIBITORS CEPHALON, INC. (US) 2009-08-26 EP disclosed
US-20080032972-A1 Pyridopyrazines and derivatives thereof as alk and c-Met inhibitors CEPHALON, INC. (US) 2008-02-07 US disclosed
WO-2007130468-A2 PYRIDO [2, 3-B] PYRAZINE AND [1, 8] -NAPHTHYRIDINE DERIVATIVES AS ALK AND C-MET INHIBITORS CEPHALON, INC. (US) 2007-11-15 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 (3 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-20110160204-A1 PYRIDOPYRAZINES AND DERIVATIVES THEREOF AS ALK AND c-MET INHIBITORS ALK, MET, RET HTT 3168/4885LMNA 2517/4885KMT2A 800/4885
US-20100048576-A1 PYRIDOPYRAZINES AND DERIVATIVES THEREOF AS ALK AND c-MET INHIBITORS ALK, MET, RET HTT 3168/4885LMNA 2517/4885KMT2A 800/4885
US-20080032972-A1 Pyridopyrazines and derivatives thereof as alk and c-Met inhibitors ALK, MET, RET HTT 3168/4885LMNA 2517/4885KMT2A 800/4885

“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.