SCHEMBL8201737

SCHEMBL8201737

C=C(F)C(=O)OCC(COC(=O)C(=C)F)(COC(=O)C(=C)F)COC(=O)C(=C)F

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.35
HIF1A Q16665 2/20 0.35
ALDH1A1 P00352 1/20 0.35
TP53 P04637 1/20 0.35
CYP3A4 P08684 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HTT P42858 1/20 0.30

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
SCHEMBL8206000 0.89 ALDH1A1 (0.50) MAPK1HIF1AALDH1A1TP53CYP3A4
SCHEMBL11805226 0.89 ALDH1A1 (0.45) MAPK1HIF1AALDH1A1TP53CYP3A4
SCHEMBL8202338 0.87 THRB (0.41) MAPK1HIF1AALDH1A1TP53CYP3A4
SCHEMBL1122824 0.83 HTT (0.48) ALDH1A1HTT
SCHEMBL11805516 0.82 ALDH1A1 (0.40) MAPK1HIF1AALDH1A1TP53CYP3A4
SCHEMBL5889495 0.81 HTT (0.32) HTT
SCHEMBL8204374 0.81 SERPINE1 (0.36)
SCHEMBL5358470 0.81
SCHEMBL5889455 0.81 HTT (0.32) HTT
SCHEMBL2527318 0.81 HTT (0.32) HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0633618-B1 LITHIUM SECONDARY CELL TDK CORP (JP) 2000-03-22 EP disclosed
EP-0662728-B1 Lithium secondary cell TDK CORP (JP) 1998-04-29 EP disclosed
US-5589297-A POWER SUPPLIES FOR DRIVING PORTABLE ELECTRONIC APPLIANCES TDK CORPORATION (JP) 1996-12-31 US disclosed
US-5565284-A STABILITY DURING CHARGING, DISCHARGING CYCLES TDK CORPORATION (JP) 1996-10-15 US disclosed
EP-0662728-A1 Lithium secondary cell TDK Corporation (JP) 1995-07-12 EP disclosed
EP-0633618-A1 LITHIUM SECONDARY CELL TDK Corporation (JP) 1995-01-11 EP disclosed