SCHEMBL1663842

SCHEMBL1663842

N#Cc1cc(Nc2ccc(N3CCC(O)CC3)cc2)ccc1Nc1ccc(NC(=O)c2ccc3[nH]ccc3c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
ESR1 P03372 1/20 0.43
MAPT P10636 4/20 0.42
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
ALDH1A1 P00352 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
RXFP1 Q9HBX9 2/20 0.42
HPGD P15428 1/20 0.42
HSD17B10 Q99714 1/20 0.42
RAB9A P51151 5/20 0.41
NPC1 O15118 4/20 0.41
JAK2 O60674 2/20 0.41
TBK1 Q9UHD2 2/20 0.41
POLB P06746 1/20 0.41
MCL1 Q07820 1/20 0.41
CHRNA7 P36544 1/20 0.41
TNIK Q9UKE5 1/20 0.40

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
SCHEMBL1663845 0.97 ESR1 (0.47) MAOAMAOBESR1MAPTMEN1
SCHEMBL1665855 0.89 MAOA (0.53) MAOAMAOBESR1MAPTMEN1
SCHEMBL1665857 0.88 MAOA (0.52) MAOAMAOBESR1MAPTMEN1
SCHEMBL1665596 0.86 MAPT (0.54) MAPTMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL1664932 0.86 ALDH1A1 (0.42) MAPTMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL1664862 0.85 NPC1 (0.49) MAOAMAOBESR1MAPTMEN1
SCHEMBL1664886 0.85 MAOB (0.58) MAOAMAOBESR1MAPTMEN1
SCHEMBL1664865 0.84 NPC1 (0.51) MAOAMAOBESR1MAPTMEN1
SCHEMBL1664889 0.84 MAOA (0.57) MAOAMAOBESR1MAPTMEN1
SCHEMBL1667400 0.84 NPC1 (0.51) MAOAMAOBESR1MAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2488486-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES Ligand Pharmaceuticals Inc. (US) 2012-08-22 EP disclosed
WO-2011046954-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES LIGAND PHARMACEUTICALS INC. (US) 2011-04-21 WO disclosed