SCHEMBL7385209

SCHEMBL7385209

CCC(O)CC(=O)NOC1CCCCO1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CCNA2 P20248 1/20 0.34
CDK2 P24941 1/20 0.34
CCNA1 P78396 1/20 0.34
CDK5 Q00535 1/20 0.34
CDK5R1 Q15078 1/20 0.34
EPHX2 P34913 1/20 0.34
DRD2 P14416 5/20 0.33
HTR2A P28223 5/20 0.33
DRD3 P35462 5/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
GSTP1 P09211 1/20 0.31
GSTM2 P28161 1/20 0.31
SLC6A3 Q01959 2/20 0.31
TGFBR1 P36897 1/20 0.31
HTT P42858 1/20 0.30

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
SCHEMBL30940157 0.82 CCNA2 (0.38) CCNA2CDK2CCNA1CDK5CDK5R1
SCHEMBL16569372 0.80 ALDH1A1 (0.39) CCNA2CDK2CCNA1CDK5CDK5R1
SCHEMBL20764812 0.80 ALDH1A1 (0.39) CCNA2CDK2CCNA1CDK5CDK5R1
SCHEMBL29397580 0.77 USP2 (0.38) CCNA2CDK2CCNA1CDK5CDK5R1
SCHEMBL4635104 0.76 MME (0.41) CCNA2CDK2CCNA1CDK5CDK5R1
SCHEMBL29400724 0.76 NAAA (0.41) MEN1KMT2A
SCHEMBL4633169 0.76 MME (0.42) MEN1KMT2ASLC6A3HTT
SCHEMBL4633172 0.76 MME (0.42) MEN1KMT2ASLC6A3HTT
SCHEMBL10704937 0.75 NAAA (0.43) MEN1KMT2A
SCHEMBL29870434 0.75 NAAA (0.43) MEN1KMT2A

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-1019386-A1 REVERSE HYDROXAMATE DERIVATIVES AS METALLOPROTEASE INHIBITORS GLAXO GROUP LIMITED (GB) 2000-07-19 EP disclosed
WO-1998038179-A1 REVERSE HYDROXAMATE DERIVATIVES AS METALLOPROTEASE INHIBITORS GLAXO GROUP LIMITED (GB) 1998-09-03 WO disclosed