SCHEMBL21780152

SCHEMBL21780152

O=C(OCC1COC(=O)O1)OCC(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.35
MAPK1 P28482 1/20 0.35
HTT P42858 1/20 0.33
TP53 P04637 1/20 0.31
CYP3A4 P08684 1/20 0.31

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
SCHEMBL9644015 0.87 L3MBTL1 (0.38) L3MBTL1MAPK1TP53CYP3A4
SCHEMBL21781851 0.84 L3MBTL1 (0.41) L3MBTL1MAPK1TP53CYP3A4
SCHEMBL18137795 0.84 L3MBTL1 (0.32) L3MBTL1MAPK1
SCHEMBL18135327 0.83 L3MBTL1 (0.31) L3MBTL1MAPK1
SCHEMBL7872110 0.80 ALDH1A1 (0.42) L3MBTL1MAPK1CYP3A4
SCHEMBL2506102 0.80 L3MBTL1 (0.37) L3MBTL1MAPK1TP53CYP3A4
SCHEMBL17461578 0.80 ALDH1A1 (0.42) L3MBTL1MAPK1CYP3A4
SCHEMBL23456653 0.80 L3MBTL1 (0.30) L3MBTL1MAPK1
SCHEMBL12310526 0.80 TSHR (0.35) MAPK1
SCHEMBL17972648 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3618166-B1 LITHIUM ION BATTERY NON-AQUEOUS ELECTROLYTE AND LITHIUM ION BATTERY SHENZHEN CAPCHEM TECHNOLOGY CO LTD (CN) 2021-05-05 EP disclosed
EP-3618164-A1 LITHIUM ION BATTERY NON-AQUEOUS ELECTROLYTE AND LITHIUM ION BATTERY Shenzhen Capchem Technology Co., Ltd (CN) 2020-03-04 EP disclosed
EP-3618166-A1 LITHIUM ION BATTERY NON-AQUEOUS ELECTROLYTE AND LITHIUM ION BATTERY Shenzhen Capchem Technology Co., Ltd (CN) 2020-03-04 EP disclosed