SCHEMBL28959657

SCHEMBL28959657

O=C(O)[C@@H]1CCC(=O)N1O.[Cu]

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACE P12821 6/20 0.44
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
MMP2 P08253 1/20 0.31
MMP9 P14780 1/20 0.31
HTT P42858 1/20 0.31
POLB P06746 1/20 0.31
GAA P10253 1/20 0.31
AKR1C3 P42330 1/20 0.30
AKR1C2 P52895 1/20 0.30
ITGB1 P05556 1/20 0.30
ITGA5 P08648 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
SCHEMBL2345094 0.98 ACE (0.45) ACEMEN1KMT2AMMP2MMP9
SCHEMBL2345097 0.98 ACE (0.45) ACEMEN1KMT2AMMP2MMP9
SCHEMBL29929647 0.77 ACE (0.33) ACEMMP2MMP9
SCHEMBL28228231 0.76 ACE (0.45) ACEMEN1KMT2AMMP2MMP9
SCHEMBL23211224 0.74 ACE (0.44) ACEMEN1KMT2AMMP2MMP9
SCHEMBL18832362 0.74 ACE (0.44) ACEMEN1KMT2AMMP2MMP9
SCHEMBL1587617 0.74 ACE (0.47) ACE
SCHEMBL11707855 0.74 ACE (0.44) ACEMEN1KMT2AMMP2MMP9
SCHEMBL9630278 0.74 ACE (0.44) ACEMEN1KMT2AMMP2MMP9
SCHEMBL2715722 0.74 ACE (0.56) ACEMEN1KMT2AMMP2MMP9

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
CN-115043429-A Preparation method of layered hydroxyl copper pyrovanadate anode material 重庆镁储新材料科技有限公司 2022-09-13 CN disclosed
CN-115043429-A Preparation method of layered hydroxyl copper pyrovanadate anode material 重庆镁储新材料科技有限公司 2022-09-13 CN disclosed