SCHEMBL29650595

SCHEMBL29650595

O=C1C(=O)c2ccccc2C=C1Br

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.57
KMT2A Q03164 5/20 0.57
MAPT P10636 5/20 0.57
MAPK1 P28482 2/20 0.57
CDC25B P30305 3/20 0.52
CDC25A P30304 1/20 0.52
PTPRC P08575 6/20 0.48
POLB P06746 4/20 0.46
CES1 P23141 3/20 0.46
KDM4E B2RXH2 2/20 0.46
LMNA P02545 2/20 0.46
BCHE P06276 2/20 0.46
THRB P10828 2/20 0.46
RECQL P46063 2/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
HTT P42858 2/20 0.46
APAF1 O14727 2/20 0.46
TDP2 O95551 2/20 0.46
CES2 O00748 1/20 0.46

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
SCHEMBL4337875 1.00 MEN1 (0.57) MEN1KMT2AMAPTMAPK1CDC25B
SCHEMBL5087254 0.93 MAPT (0.64) MEN1KMT2AMAPTMAPK1CDC25B
SCHEMBL826206 0.78
SCHEMBL28277167 0.74 BACE1 (0.57) MEN1KMT2AMAPTMAPK1CDC25B
SCHEMBL29809142 0.74 BACE1 (0.57) MEN1KMT2AMAPTMAPK1CDC25B
SCHEMBL8773161 0.74 S100A4 (0.56) MEN1KMT2AMAPTMAPK1PTPRC
SCHEMBL2971465 0.73 MAPK1 (0.42) MEN1KMT2AMAPTMAPK1CDC25B
SCHEMBL3444897 0.73 CDC25B (0.57) MEN1KMT2AMAPTMAPK1CDC25B
SCHEMBL9353957 0.73 CDC25B (0.52) MEN1KMT2AMAPTMAPK1CDC25B
SCHEMBL8731780 0.73 CDC25B (0.52) MEN1KMT2AMAPTMAPK1CDC25B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117613381-A Electrolyte containing six-membered cyclic sulfate 索尔维公司 2024-02-27 CN disclosed
CN-117438649-A Nonaqueous electrolyte composition 索尔维公司 2024-01-23 CN disclosed
CN-109643822-B Nonaqueous electrolyte composition comprising fluorinated sulfone 索尔维公司 2023-04-28 CN disclosed
CN-109643827-B Non-aqueous electrolyte composition comprising silyl oxalate 索尔维公司 2023-02-07 CN disclosed
CN-114762170-A Electrolyte compositions with fluorinated acyclic carbonates and fluorinated cyclic carbonates 索尔维公司 2022-07-15 CN disclosed
CN-114762147-A Electrolyte compositions with fluorinated acyclic esters and fluorinated cyclic carbonates 索尔维公司 2022-07-15 CN disclosed
CN-107949948-B Non-aqueous electrolyte composition containing lithium oxalate phosphate 索尔维公司 2022-07-05 CN disclosed