SCHEMBL7206074

SCHEMBL7206074

NCCCCCCC(=O)C(N)(CNCCN)C(=O)CCCCCCN

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 2/20 0.50
KMT2A Q03164 3/20 0.42
ALOX15 P16050 2/20 0.42
MEN1 O00255 2/20 0.42
RECQL P46063 2/20 0.42
LMNA P02545 2/20 0.42
THRB P10828 2/20 0.42
ALDH1A1 P00352 1/20 0.42
PLG P00747 1/20 0.42
SLC6A2 P23975 1/20 0.42
SLC6A3 Q01959 1/20 0.42
PAOX Q6QHF9 4/20 0.42
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
CYP2D6 P10635 1/20 0.39
NFKB1 P19838 1/20 0.39
BLM P54132 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
SLC6A5 Q9Y345 2/20 0.36
ITGB3 P05106 1/20 0.33

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
SCHEMBL7209111 0.95 HDAC6 (0.57) HDAC6KMT2AALOX15MEN1RECQL
SCHEMBL7204433 0.92 HDAC6 (0.44) HDAC6KMT2AALOX15MEN1RECQL
SCHEMBL7206092 0.87 HDAC6 (0.49) HDAC6KMT2AALOX15MEN1RECQL
SCHEMBL7205788 0.79 HDAC6 (0.60) HDAC6KMT2AALOX15MEN1RECQL
SCHEMBL7202891 0.79 HDAC6 (0.60) HDAC6KMT2AALOX15MEN1RECQL
SCHEMBL7694329 0.79 HDAC6 (0.60) HDAC6KMT2AALOX15MEN1RECQL
SCHEMBL8749600 0.69 FAAH (0.48) KMT2AMEN1ALDH1A1CYP1A2TSHR
SCHEMBL18350804 0.67 PAOX (0.56) HDAC6KMT2AALOX15MEN1RECQL
SCHEMBL13893493 0.67 PAOX (0.56) HDAC6KMT2AALOX15MEN1RECQL
SCHEMBL13893494 0.67 PAOX (0.56) HDAC6KMT2AALOX15MEN1RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0912584-B1 NEW BIS-PLATINUM COMPLEXES WITH POLYAMINE LIGANDS AS ANTITUMOR AGENTS HOFFMANN LA ROCHE (CH) 2002-12-18 EP disclosed
EP-0912584-A2 NEW BIS-PLATINUM COMPLEXES WITH POLYAMINE LIGANDS AS ANTITUMOR AGENTS F. HOFFMANN-LA ROCHE AG (CH) 1999-05-06 EP disclosed
WO-1998003519-A9 NEW BIS-PLATINUM COMPLEXES WITH POLYAMINE LIGANDS AS ANTITUMOR AGENTS 1998-07-16 WO disclosed
WO-1998003519-A2 NEW BIS-PLATINUM COMPLEXES WITH POLYAMINE LIGANDS AS ANTITUMOR AGENTS F. HOFFMANN-LA ROCHE AG (CH) 1998-01-29 WO disclosed