SCHEMBL1664686

SCHEMBL1664686

Cn1cccc1C(=O)Nc1ccc(Nc2ccc(Nc3ccc(N4CCC(O)CC4)cc3)cc2C#N)cc1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 13/20 0.54
MEN1 O00255 2/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPT P10636 2/20 0.39
HPGD P15428 2/20 0.39
KMT2A Q03164 2/20 0.39
HSD17B10 Q99714 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
PDE7A Q13946 2/20 0.38
EGFR P00533 2/20 0.38
JAK2 O60674 1/20 0.37
TBK1 Q9UHD2 1/20 0.37
KDM4E B2RXH2 1/20 0.37

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
SCHEMBL1664688 0.94 HPGDS (0.51) HPGDSMEN1ALDH1A1MAPTHPGD
SCHEMBL1664890 0.89 HPGDS (0.43) HPGDSMEN1ALDH1A1MAPTHPGD
SCHEMBL1664868 0.87 HPGDS (0.57) HPGDSALDH1A1MAPTSMN1; SMN2NPSR1
SCHEMBL1663363 0.86 HPGDS (0.56) HPGDSALDH1A1PDE7AEGFR
SCHEMBL1664362 0.86 HPGDS (0.56) HPGDSALDH1A1MAPTSMN1; SMN2PDE7A
SCHEMBL1664943 0.86 HPGDS (0.42) HPGDSMEN1ALDH1A1MAPTHPGD
SCHEMBL1664481 0.85 SMN1; SMN2 (0.45) HPGDSMEN1ALDH1A1MAPTHPGD
SCHEMBL1664163 0.85 SMN1; SMN2 (0.44) HPGDSMEN1ALDH1A1MAPTHPGD
SCHEMBL1666155 0.84 HPGDS (0.56) HPGDSPDE7AEGFR
SCHEMBL1664557 0.84 HPGDS (0.54) HPGDSPDE7AEGFR

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-2642994-A2 USE OF HEMATOPOIETIC GROWTH FACTOR MIMETICS Ligand Pharmaceuticals Incorporated (US) 2013-10-02 EP disclosed
EP-2488486-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES Ligand Pharmaceuticals Inc. (US) 2012-08-22 EP disclosed
WO-2012068406-A2 USE OF HEMATOPOIETIC GROWTH FACTOR MIMETICS LIGAND PHARMACEUTICALS INCORPORATED (US) 2012-05-24 WO disclosed
WO-2011046954-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES LIGAND PHARMACEUTICALS INC. (US) 2011-04-21 WO disclosed