SCHEMBL28948424

SCHEMBL28948424

C=CCCOC(=O)/C=C/C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 9/20 0.59
ATM Q13315 1/20 0.42
MAPT P10636 2/20 0.39
CACNA1B Q00975 1/20 0.39
APBA1 Q02410 1/20 0.39
TSHR P16473 6/20 0.39
ALDH1A1 P00352 4/20 0.39
TP53 P04637 3/20 0.39
HIF1A Q16665 2/20 0.39
CYP3A4 P08684 1/20 0.39
HSD17B10 Q99714 1/20 0.39
ABCC4 O15439 1/20 0.38
EGLN1 Q9GZT9 1/20 0.38
EGLN3 Q9H6Z9 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL28135946 1.00 HCAR2 (0.59) HCAR2ATMMAPTCACNA1BAPBA1
SCHEMBL10917799 1.00 HCAR2 (0.59) HCAR2ATMMAPTCACNA1BAPBA1
SCHEMBL20954170 0.91 ATM (0.48) HCAR2ATMMAPTCACNA1BAPBA1
SCHEMBL10917794 0.91 ATM (0.48) HCAR2ATMMAPTCACNA1BAPBA1
SCHEMBL29220141 0.90 HCAR2 (0.63) HCAR2ATMMAPTCACNA1BAPBA1
SCHEMBL9860583 0.90 HCAR2 (0.63) HCAR2ATMMAPTCACNA1BAPBA1
SCHEMBL29220180 0.88 HCAR2 (0.65) HCAR2ATMMAPTCACNA1BAPBA1
SCHEMBL28338258 0.86 HCAR2 (0.66) HCAR2ATMMAPTTSHRALDH1A1
SCHEMBL28879793 0.85 HCAR2 (0.64) HCAR2ATMMAPTTSHRALDH1A1
SCHEMBL19219840 0.82 HCAR2 (0.50) HCAR2ATMMAPTTSHRALDH1A1

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-115668569-A Electrolyte solution, electrochemical device, lithium ion secondary battery, and assembly 大金工业株式会社 2023-01-31 CN disclosed
CN-115668571-A Electrolyte solution, electrochemical device, lithium ion secondary battery, module, and compound 大金工业株式会社 2023-01-31 CN disclosed