SCHEMBL31473135

SCHEMBL31473135

CC(C)(C)OC[C@H]1C(=O)N2CCOCC2C(=O)N1Cc1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 3/20 0.34
MMP1 P03956 1/20 0.34
MMP3 P08254 1/20 0.34
MMP9 P14780 1/20 0.34
PLA2G10 O15496 1/20 0.34
PLA2G5 P39877 1/20 0.34
EHMT2 Q96KQ7 1/20 0.34
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
PIK3C3 Q8NEB9 2/20 0.33
ATM Q13315 1/20 0.33
HCRTR1 O43613 1/20 0.33
HCRTR2 O43614 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
CYP2C19 P33261 2/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
HSD17B10 Q99714 1/20 0.33
BMPR1B O00238 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
SCHEMBL30769645 0.90 PDE1A (0.31) ALDH1A1KDM4EPIK3C3HCRTR1HCRTR2
SCHEMBL31473149 0.84 KMT2A (0.42) PLA2G10PLA2G5ALDH1A1KDM4EHCRTR1
SCHEMBL31473146 0.83 GAA (0.33) ALDH1A1GAA
SCHEMBL303241 0.82 EHMT2 (0.38) RIPK1EHMT2ALDH1A1KDM4EPIK3C3
SCHEMBL31758029 0.82 PLA2G10 (0.37) MMP1MMP3MMP9PLA2G10PLA2G5
SCHEMBL30769547 0.77 GPR119 (0.41) PLA2G10PLA2G5HDAC6BRD4
SCHEMBL31473158 0.72 EHMT2 (0.40) MMP1MMP3MMP9PLA2G10PLA2G5
SCHEMBL17926108 0.70 ADORA2A (0.54) ALDH1A1KDM4EMAPK1GSK3BMEN1
SCHEMBL31473165 0.68 ITGB3 (0.35) ALDH1A1PIK3C3HDAC6
SCHEMBL30769681 0.68 GPR119 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119403810-A Compounds, pharmaceutical compositions containing them and their medical use for the treatment or prevention of vascular diseases 瓦斯塞拉股份有限公司 2025-02-07 CN disclosed