SCHEMBL6261982

SCHEMBL6261982

Nc1c(O)n(-c2ccccc2)n(-c2ccccc2)c1=O

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.53
PTGS2 P35354 1/20 0.53
ALDH1A1 P00352 3/20 0.44
ALOX15 P16050 1/20 0.44
MAPK1 P28482 1/20 0.41
KMT2A Q03164 3/20 0.40
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
KDM4E B2RXH2 1/20 0.37
MAPT P10636 1/20 0.36
SMN1; SMN2 Q16637 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
SCHEMBL945083 0.79 BCHE (0.56) BCHEPTGS2ALDH1A1ALOX15MAPK1
SCHEMBL3695114 0.76 BCHE (0.73) BCHEPTGS2ALDH1A1ALOX15KMT2A
SCHEMBL12511299 0.76 ALDH1A1 (0.53) BCHEPTGS2ALDH1A1ALOX15KMT2A
SCHEMBL23402967 0.74 BCHE (0.51) BCHEPTGS2ALDH1A1ALOX15MAPK1
SCHEMBL23400086 0.72 BCHE (0.53) BCHEPTGS2ALDH1A1ALOX15KMT2A
SCHEMBL23403584 0.72 BCHE (0.53) BCHEPTGS2ALDH1A1ALOX15MAPK1
SCHEMBL13946420 0.72 LMNA (0.60) PTGS2ALDH1A1ALOX15KMT2AMEN1
SCHEMBL13966824 0.72 ALDH1A1 (0.49) ALDH1A1ALOX15MAPK1KMT2AMEN1
Ampyrone SCHEMBL3092850 0.71 BCHE (0.84) BCHEPTGS2ALDH1A1ALOX15KMT2A
SCHEMBL945107 0.71 BCHE (0.71) BCHEPTGS2ALDH1A1ALOX15MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1434557-B1 AGENT FOR THE COLORATION OF KERATIN-CONTAINING FIBERS HENKEL KGAA (DE) 2005-11-09 EP claimed
EP-1434557-A1 AGENT FOR THE COLORATION OF KERATIN-CONTAINING FIBERS Henkel Kommanditgesellschaft auf Aktien (DE) 2004-07-07 EP claimed
WO-2003030845-A1 AGENT FOR THE COLORATION OF KERATIN-CONTAINING FIBERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2003-04-17 WO claimed
EP-2351650-A1 OPTICAL INFORMATION RECORDING MEDIUM, METHOD FOR INFORMATION RECORDING, AND AZO METAL COMPLEX DYE FUJIFILM Corporation (JP) 2011-08-03 EP disclosed
EP-1906401-A2 Optical information recording medium and azo-metal complex dye Fujifilm Corporation (JP) 2008-04-02 EP disclosed
EP-1434557-B1 AGENT FOR THE COLORATION OF KERATIN-CONTAINING FIBERS HENKEL KGAA (DE) 2005-11-09 EP disclosed
EP-1434557-A1 AGENT FOR THE COLORATION OF KERATIN-CONTAINING FIBERS Henkel Kommanditgesellschaft auf Aktien (DE) 2004-07-07 EP disclosed
WO-2003030845-A1 AGENT FOR THE COLORATION OF KERATIN-CONTAINING FIBERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2003-04-17 WO disclosed