SCHEMBL1933360

SCHEMBL1933360

CC(C)(C)NC(=O)Nc1ccnc2cc(Br)cnc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKB Q96GD4 7/20 0.62
MAPK1 P28482 5/20 0.62
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
ALDH1A1 P00352 3/20 0.48
TP53 P04637 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
KDM4E B2RXH2 1/20 0.48
GAA P10253 1/20 0.48
HPGD P15428 1/20 0.48
CASP1 P29466 1/20 0.48
CASP7 P55210 1/20 0.48
HSD17B10 Q99714 1/20 0.48
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
HCRTR1 O43613 2/20 0.36
HCRTR2 O43614 2/20 0.36
HTR2C P28335 2/20 0.36
ADORA2A P29274 2/20 0.36
CYP1A2 P05177 1/20 0.36

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
SCHEMBL1933839 0.82 AURKB (0.61) AURKBMAPK1NPC1RAB9A
SCHEMBL1933760 0.82 MAPK1 (0.48) AURKBMAPK1NPC1RAB9AALDH1A1
SCHEMBL34471939 0.81 AURKB (0.44) AURKBMAPK1KDRSRC
SCHEMBL1961793 0.80 AURKB (0.51) AURKBMAPK1NPC1RAB9ASMN1; SMN2
SCHEMBL1933647 0.80 AURKB (0.61) AURKBMAPK1NPC1RAB9AALDH1A1
SCHEMBL1932399 0.79 AURKB (0.45) AURKBMAPK1KDRFGFR1
SCHEMBL1933924 0.79 HTT (0.49) AURKBMAPK1NPC1RAB9AALDH1A1
SCHEMBL1933597 0.78 RAB9A (0.59) AURKBMAPK1NPC1RAB9ASMN1; SMN2
SCHEMBL1933961 0.78 AURKB (0.66) AURKBMAPK1NPC1RAB9AALDH1A1
SCHEMBL1933004 0.77 AURKB (1.00) AURKBMAPK1NPC1RAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2504336-B1 NOVEL NAPHTHYRIDINE DERIVATIVES AND THE USE THEREOF AS KINASE INHIBITORS ÆTERNA ZENTARIS GMBH (DE) 2016-03-30 EP disclosed
EP-2504336-B1 NOVEL NAPHTHYRIDINE DERIVATIVES AND THE USE THEREOF AS KINASE INHIBITORS ÆTERNA ZENTARIS GMBH (DE) 2016-03-30 EP disclosed
US-8461178-B2 Naphthyridine derivatives and the use thereof as kinase inhibitors AETERNA ZENTARIS GMBH (DE) 2013-06-11 US disclosed
US-8461178-B2 Naphthyridine derivatives and the use thereof as kinase inhibitors AETERNA ZENTARIS GMBH (DE) 2013-06-11 US disclosed
US-8461178-B2 Naphthyridine derivatives and the use thereof as kinase inhibitors AETERNA ZENTARIS GMBH (DE) 2013-06-11 US disclosed
EP-2504336-A1 NOVEL NAPHTHYRIDINE DERIVATIVES AND THE USE THEREOF AS KINASE INHIBITORS Æterna Zentaris GmbH (DE) 2012-10-03 EP disclosed
US-20110150831-A1 NOVEL NAPHTHYRIDINE DERIVATIVES AND THE USE THEREOF AS KINASE INHIBITORS AETERNA ZENTARIS GMBH (DE) 2011-06-23 US disclosed
US-20110150831-A1 NOVEL NAPHTHYRIDINE DERIVATIVES AND THE USE THEREOF AS KINASE INHIBITORS AETERNA ZENTARIS GMBH (DE) 2011-06-23 US disclosed
US-20110150831-A1 NOVEL NAPHTHYRIDINE DERIVATIVES AND THE USE THEREOF AS KINASE INHIBITORS AETERNA ZENTARIS GMBH (DE) 2011-06-23 US disclosed
EP-2332939-A1 Novel Naphthyridine derivatives and the use thereof as kinase inhibitors Æterna Zentaris GmbH (DE) 2011-06-15 EP disclosed
EP-2332939-A1 Novel Naphthyridine derivatives and the use thereof as kinase inhibitors Æterna Zentaris GmbH (DE) 2011-06-15 EP disclosed
WO-2011064250-A1 NOVEL NAPHTHYRIDINE DERIVATIVES AND THE USE THEREOF AS KINASE INHIBITORS ÆTERNA ZENTARIS GMBH (DE) 2011-06-03 WO disclosed
WO-2011064250-A1 NOVEL NAPHTHYRIDINE DERIVATIVES AND THE USE THEREOF AS KINASE INHIBITORS ÆTERNA ZENTARIS GMBH (DE) 2011-06-03 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-20110150831-A1 NOVEL NAPHTHYRIDINE DERIVATIVES AND THE USE THEREOF AS KINASE INHIBITORS MAP3K1, MAP3K20, MAP3K2 AURKB 389/4885MAPK1 26/4885NPC1 1569/4885

“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.