SCHEMBL22118488

SCHEMBL22118488

C=CC(=O)OC(=O)C(=C)c1ccco1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.46
CES1 P23141 1/20 0.46
PTPN1 P18031 2/20 0.42
ALDH1A1 P00352 6/20 0.41
KMT2A Q03164 4/20 0.41
POLB P06746 3/20 0.41
MEN1 O00255 2/20 0.41
RECQL P46063 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
THRB P10828 1/20 0.41
APEX1 P27695 1/20 0.41
LMNA P02545 1/20 0.38
AGTR1 P30556 1/20 0.38
GAA P10253 1/20 0.38
HTT P42858 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HSD17B10 Q99714 2/20 0.37
ERCC5 P28715 1/20 0.37
FEN1 P39748 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL6652799 0.83 KMT2A (0.50) CES2CES1PTPN1ALDH1A1KMT2A
SCHEMBL2029061 0.77 CES2 (0.55) CES2CES1PTPN1ALDH1A1KMT2A
SCHEMBL14102645 0.74 CES2 (0.45) CES2CES1PTPN1ALDH1A1KMT2A
SCHEMBL506075 0.74 AKT1 (0.48) CES2CES1ALDH1A1KMT2APOLB
SCHEMBL29156597 0.73 CES2 (0.46) CES2CES1PTPN1ALDH1A1KMT2A
SCHEMBL6310287 0.73 NPC1 (0.50) CES2CES1ALDH1A1KMT2APOLB
SCHEMBL13656481 0.73 CES2 (0.56) CES2CES1PTPN1ALDH1A1KMT2A
SCHEMBL28254404 0.72 KMT2A (0.50) CES2CES1PTPN1ALDH1A1KMT2A
SCHEMBL23069153 0.72 CES2 (0.58) CES2CES1PTPN1ALDH1A1KMT2A
SCHEMBL2134381 0.72

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
WO-2020132057-A1 SILICON-BASED ENERGY STORAGE DEVICES WITH ANHYDRIDE CONTAINING ELECTROLYTE ADDITIVES ENEVATE CORPORATION (US) 2020-06-25 WO claimed
US-20200203711-A1 SILICON-BASED ENERGY STORAGE DEVICES WITH ANHYDRIDE CONTAINING ELECTROLYTE ADDITIVES ENEVATE CORPORATION 2020-06-25 US claimed
US-11837711-B2 Silicon-based energy storage devices with anhydride containing electrolyte additives ENEVATE CORPORATION (US) 2023-12-05 US disclosed
US-20210167361-A1 SILICON-BASED ENERGY STORAGE DEVICES WITH ANHYDRIDE CONTAINING ELECTROLYTE ADDITIVES ENEVATE CORPORATION 2021-06-03 US disclosed
US-10957898-B2 Silicon-based energy storage devices with anhydride containing electrolyte additives ENEVATE CORPORATION (US) 2021-03-23 US disclosed
WO-2020132057-A1 SILICON-BASED ENERGY STORAGE DEVICES WITH ANHYDRIDE CONTAINING ELECTROLYTE ADDITIVES ENEVATE CORPORATION (US) 2020-06-25 WO disclosed
US-20200203711-A1 SILICON-BASED ENERGY STORAGE DEVICES WITH ANHYDRIDE CONTAINING ELECTROLYTE ADDITIVES ENEVATE CORPORATION 2020-06-25 US disclosed