SCHEMBL4637130

SCHEMBL4637130

NC(CC(=O)O)N1CCCCC1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 1/20 0.60
CYP1A2 P05177 2/20 0.38
MAPK1 P28482 2/20 0.38
CYP2C9 P11712 1/20 0.38
HPGD P15428 1/20 0.38
CYP2C19 P33261 1/20 0.38
ALDH1A1 P00352 1/20 0.37
DPP4 P27487 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
FDPS P14324 2/20 0.35
GAA P10253 1/20 0.35
ANPEP P15144 1/20 0.34
ERAP2 Q6P179 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
GABRR1 P24046 2/20 0.33
LMNA P02545 2/20 0.33
SLC22A6 Q4U2R8 1/20 0.33
HTT P42858 1/20 0.33
GRIK1 P39086 1/20 0.33

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
SCHEMBL4637394 0.83 DPP7 (0.55) DPP7CYP1A2MAPK1CYP2C9HPGD
SCHEMBL28321075 0.80 DPP7 (0.52) DPP7CYP1A2MAPK1CYP2C9HPGD
SCHEMBL16151189 0.79 DPP7 (0.39) DPP7DPP4ANPEPERAP2
SCHEMBL7935848 0.76 DPP7 (0.49) DPP7MAPK1ALDH1A1SMN1; SMN2FDPS
SCHEMBL4669860 0.76 DPP7 (0.53) DPP7CYP1A2MAPK1ALDH1A1DPP4
SCHEMBL5500053 0.74 KDM4E (0.46) DPP7CYP1A2MAPK1CYP2C9HPGD
SCHEMBL28295367 0.74 DPP7 (0.46) DPP7CYP1A2MAPK1CYP2C9HPGD
SCHEMBL8625882 0.74 DPP7 (0.46) DPP7CYP1A2MAPK1CYP2C9HPGD
SCHEMBL499913 0.74 KDM4E (0.46) DPP7CYP1A2MAPK1CYP2C9HPGD
SCHEMBL28340631 0.74 DPP7 (0.70) DPP7CYP1A2ALDH1A1GRIK1

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-1879859-A2 DIARYLSULFONE SULFONAMIDES AND USE THEROF Wyeth a Corporation of the State of Delaware (US) 2008-01-23 EP claimed
WO-2006124875-A2 DIARYLSULFONE SULFONAMIDES AND USE THEROF WYETH (US) 2006-11-23 WO claimed
EP-1879859-A2 DIARYLSULFONE SULFONAMIDES AND USE THEROF Wyeth a Corporation of the State of Delaware (US) 2008-01-23 EP disclosed
WO-2006124875-A2 DIARYLSULFONE SULFONAMIDES AND USE THEROF WYETH (US) 2006-11-23 WO disclosed