SCHEMBL1665848

SCHEMBL1665848

Cn1ccc(C(=O)Nc2ccc(Nc3ccc(Nc4ccc(N5CCC(O)CC5)cc4)cc3)c(F)c2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE7A Q13946 2/20 0.40
HTT P42858 2/20 0.40
SLC2A1 P11166 1/20 0.40
HDAC3 O15379 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HPGDS O60760 1/20 0.39
CSF1R P07333 1/20 0.39
MAPT P10636 6/20 0.39
LMNA P02545 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MAPK8 P45983 1/20 0.39
NPC1 O15118 6/20 0.39
RAB9A P51151 6/20 0.39
SMN1; SMN2 Q16637 6/20 0.39
TP53 P04637 2/20 0.39
TSHR P16473 1/20 0.39
EGFR P00533 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 2/20 0.38

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
SCHEMBL1664440 0.97 HPGDS (0.41) PDE7AHTTHDAC3HDAC8HPGDS
SCHEMBL1664442 0.96 NPC1 (0.43) HTTSLC2A1HDAC3HDAC8MAPT
SCHEMBL1665852 0.96 NPC1 (0.43) HTTSLC2A1HDAC3HDAC8MAPT
SCHEMBL8772733 0.91 MCHR1 (0.42) PDE7AHTTSLC2A1HDAC3HDAC8
SCHEMBL13836604 0.91 MCHR1 (0.42) PDE7AHTTSLC2A1HDAC3HDAC8
SCHEMBL1664809 0.89 EGFR (0.42) HTTHPGDSCSF1RMAPTLMNA
SCHEMBL1665275 0.88 SLC2A1 (0.38) PDE7AHTTSLC2A1HDAC3HDAC8
SCHEMBL1664624 0.87 ALDH1A1 (0.46) PDE7AHPGDSCSF1RMAPTLMNA
SCHEMBL1662766 0.86 RAB9A (0.51) HTTHDAC8HPGDSMAPTLMNA
SCHEMBL1666960 0.86 ALDH1A1 (0.46) PDE7AHTTSLC2A1HDAC3HDAC8

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