SCHEMBL8993155

SCHEMBL8993155

NCCCCCCCCN(Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.81

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 2/20 0.54
HDAC1 Q13547 2/20 0.54
HDAC2 Q92769 2/20 0.54
HDAC8 Q9BY41 2/20 0.54
NCOR2 Q9Y618 2/20 0.54
MAOA P21397 1/20 0.52
CARM1 Q86X55 1/20 0.50
PRMT6 Q96LA8 1/20 0.50
PRMT8 Q9NR22 1/20 0.50
SIGMAR1 Q99720 1/20 0.46
MC4R P32245 1/20 0.46
MC5R P33032 1/20 0.46
MC3R P41968 1/20 0.46
BCHE P06276 1/20 0.45
ACHE P22303 1/20 0.45

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
SCHEMBL1983580 1.00 HDAC3 (0.54) HDAC3HDAC1HDAC2HDAC8NCOR2
SCHEMBL8708196 1.00 HDAC3 (0.54) HDAC3HDAC1HDAC2HDAC8NCOR2
SCHEMBL5741392 0.98 MAOA (0.54) HDAC3HDAC1HDAC2HDAC8NCOR2
SCHEMBL17527067 0.96 MAOA (0.52) HDAC3HDAC1HDAC2HDAC8NCOR2
SCHEMBL16390835 0.96 MAOA (0.52) HDAC3HDAC1HDAC2HDAC8NCOR2
SCHEMBL3666097 0.96 MAOA (0.52) HDAC3HDAC1HDAC2HDAC8NCOR2
SCHEMBL17508108 0.94 MAOA (0.54) HDAC3HDAC1HDAC2HDAC8NCOR2
SCHEMBL8027241 0.92 HDAC3 (0.50) HDAC3HDAC1HDAC2HDAC8NCOR2
SCHEMBL17527074 0.92 MAOA (0.52) HDAC3HDAC1HDAC2HDAC8NCOR2
SCHEMBL1685452 0.92 CARM1 (0.53) HDAC3HDAC1HDAC2HDAC8NCOR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0399519-B1 Potentiating cell-mediated immunity utilizing polyamine derivatives MERRELL PHARMA INC (US) 1996-08-07 EP disclosed
EP-0662829-A1 POLYAMINE DERIVATIVES AS ANTI-CYTOMEGALOVIRAL AGENTS MERRELL PHARMACEUTICALS INC. (US) 1995-07-19 EP disclosed
WO-1994007480-A1 POLYAMINE DERIVATIVES AS ANTI-CYTOMEGALOVIRAL AGENTS MERRELL DOW PHARMACEUTICALS INC. (US) 1994-04-14 WO disclosed
EP-0277635-B1 Novel polyamine derivatives MERRELL DOW PHARMA (US) 1994-01-05 EP disclosed
EP-0399519-A2 Potentiating cell-mediated immunity utilizing polyamine derivatives MERRELL PHARMACEUTICALS INC. (US) 1990-11-28 EP disclosed
EP-0277635-A2 Novel polyamine derivatives MERRELL DOW PHARMACEUTICALS INC. (US) 1988-08-10 EP disclosed