SCHEMBL8529154

SCHEMBL8529154

CC(C)(C)C(CC(N)=O)C(N)=O

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ECE1 P42892 3/20 0.33
EPHX1 P07099 1/20 0.33
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
CA7 P43166 1/20 0.31
CA14 Q9ULX7 1/20 0.31
ALDH1A1 P00352 1/20 0.31
SCN10A Q9Y5Y9 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL8529151 1.00 ECE1 (0.33) ECE1EPHX1CA1CA2CA7
SCHEMBL8529461 1.00 ECE1 (0.33) ECE1EPHX1CA1CA2CA7
SCHEMBL16682790 0.83 ECE1 (0.37) ECE1ALDH1A1
SCHEMBL18273753 0.83 ECE1 (0.37) ECE1ALDH1A1
SCHEMBL20363304 0.83 ECE1 (0.33) ECE1ALDH1A1
SCHEMBL18273752 0.83 SLC22A6 (0.36)
SCHEMBL10034713 0.81 ECE1 (0.34) ECE1CA1CA2CA7CA14
SCHEMBL1705139 0.81 ECE1 (0.34) ECE1CA1CA2CA7CA14
SCHEMBL6698272 0.79 ALDH1A1 (0.30) ECE1ALDH1A1
SCHEMBL6698270 0.78 MMP1 (0.32) ECE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110799215-A Methods of treating Dravet syndrome 卡维昂公司 2020-02-14 CN claimed
CN-110770221-A Methods for improving memory and cognition and for treating memory and cognitive disorders 卡维昂公司 2020-02-07 CN claimed
EP-0827507-A1 PROTEASE INHIBITING SUCCINIC ACID DERIVATIVES BOEHRINGER INGELHEIM (CANADA) LTD. (CA) 1998-03-11 EP claimed
WO-1996031527-A1 PROTEASE INHIBITING SUCCINIC ACID DERIVATIVES BOEHRINGER INGELHEIM (CANADA) LTD./BOEHRINGER INGELHEIM (CANADA) LTÉE. (CA) 1996-10-10 WO claimed
EP-0827507-A1 PROTEASE INHIBITING SUCCINIC ACID DERIVATIVES BOEHRINGER INGELHEIM (CANADA) LTD. (CA) 1998-03-11 EP disclosed
WO-1996031527-A1 PROTEASE INHIBITING SUCCINIC ACID DERIVATIVES BOEHRINGER INGELHEIM (CANADA) LTD./BOEHRINGER INGELHEIM (CANADA) LTÉE. (CA) 1996-10-10 WO disclosed