SCHEMBL25555697

SCHEMBL25555697

CCOC(=O)C(CCC#N)(CCC#N)C(=O)OC

nearest known ligand 0.86

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.86
KMT2A Q03164 4/20 0.86
PKM P14618 3/20 0.38
L3MBTL1 Q9Y468 3/20 0.38
THRB P10828 1/20 0.38
HTT P42858 1/20 0.37
TSHR P16473 2/20 0.36
ALDH1A1 P00352 2/20 0.35
LMNA P02545 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
KDM4E B2RXH2 2/20 0.35
CYP4F2 P78329 2/20 0.34
CYP4A11 Q02928 2/20 0.34
MAPT P10636 2/20 0.34
ATM Q13315 1/20 0.34
PTPRB P23467 2/20 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
SCHEMBL1341844 0.93 MEN1 (1.00) MEN1KMT2APKML3MBTL1THRB
SCHEMBL8642675 0.89 MEN1 (0.66) MEN1KMT2APTPRB
SCHEMBL1343741 0.88 MEN1 (0.89) MEN1KMT2APKML3MBTL1THRB
SCHEMBL3653375 0.86 MEN1 (0.86) MEN1KMT2APKML3MBTL1THRB
SCHEMBL8979177 0.84 MEN1 (0.83) MEN1KMT2APKML3MBTL1THRB
SCHEMBL21202214 0.82 MEN1 (0.58) MEN1KMT2AL3MBTL1TSHRALDH1A1
SCHEMBL21202155 0.82 MEN1 (0.58) MEN1KMT2AL3MBTL1TSHRALDH1A1
SCHEMBL1343745 0.80 MEN1 (0.75) MEN1KMT2APKML3MBTL1THRB
SCHEMBL29082258 0.80 MEN1 (0.53) MEN1KMT2APKML3MBTL1THRB
SCHEMBL9131020 0.78 MEN1 (0.72) MEN1KMT2APKML3MBTL1THRB

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
WO-2023098268-A1 ELECTROLYTE, ELECTROCHEMICAL DEVICE COMPRISING SAME, AND ELECTRONIC DEVICE 宁德新能源科技有限公司 2023-06-08 WO disclosed