SCHEMBL4240846

SCHEMBL4240846

Cc1cc2c(c(Cl)n1)C(=O)OCC2.Cc1cc2c(c(N3CCCCC3)n1)C(=O)OCC2

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.55
HSD17B10 Q99714 3/20 0.55
KDM4E B2RXH2 2/20 0.55
ALDH1A1 P00352 2/20 0.55
L3MBTL1 Q9Y468 3/20 0.36
NPSR1 Q6W5P4 1/20 0.36
RECQL P46063 1/20 0.35
NPY5R Q15761 1/20 0.35
PDE10A Q9Y233 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
GLP1R P43220 1/20 0.33
FABP3 P05413 2/20 0.33
CYP2D6 P10635 2/20 0.33
CYP2C9 P11712 2/20 0.33
FABP4 P15090 2/20 0.33
FABP5 Q01469 2/20 0.33
CYP3A4 P08684 1/20 0.33
GAA P10253 2/20 0.32
CRHR1 P34998 1/20 0.32

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
SCHEMBL4063851 0.93 ALDH1A1 (0.62) HPGDHSD17B10KDM4EALDH1A1L3MBTL1
SCHEMBL4065469 0.85 ALDH1A1 (0.43) HPGDHSD17B10KDM4EALDH1A1L3MBTL1
SCHEMBL4063572 0.83 ALDH1A1 (0.78) HPGDHSD17B10KDM4EALDH1A1L3MBTL1
SCHEMBL4074550 0.83 KDM4E (0.62) HPGDHSD17B10KDM4EALDH1A1L3MBTL1
SCHEMBL4067228 0.79 KDM4E (0.57) HPGDHSD17B10KDM4EALDH1A1L3MBTL1
SCHEMBL4746294 0.77 ALDH1A1 (0.43) HPGDHSD17B10KDM4EALDH1A1L3MBTL1
SCHEMBL4749859 0.77 ALDH1A1 (0.43) HPGDHSD17B10KDM4EALDH1A1L3MBTL1
SCHEMBL4248613 0.76 KDM4E (0.43) HPGDHSD17B10KDM4EALDH1A1L3MBTL1
SCHEMBL4749923 0.76 KDM4E (0.44) HPGDHSD17B10KDM4EALDH1A1NPSR1
SCHEMBL4067394 0.74 HSD17B10 (0.47) HPGDHSD17B10KDM4EALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1706412-A4 NOVEL PYRIDINE DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND A PHARMACEUTICAL COMPOSITION CONTAINING THE SAME SK CHEMICALS CO LTD (KR) 2009-03-18 EP disclosed
EP-1706412-A1 NOVEL PYRIDINE DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND A PHARMACEUTICAL COMPOSITION CONTAINING THE SAME SK Chemicals, Co., Ltd. (KR) 2006-10-04 EP disclosed
WO-2005063768-A1 NOVEL PYRIDINE DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND A PHARMACEUTICAL COMPOSITION CONTAINING THE SAME SK CHEMICALS, CO., LTD. (KR) 2005-07-14 WO disclosed