SCHEMBL8201733

SCHEMBL8201733

C=C(F)C(=O)OCCOCCOCCOC(=O)C(=C)F

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.48
TSHR P16473 5/20 0.44
ALDH1A1 P00352 3/20 0.44
TP53 P04637 2/20 0.44
HIF1A Q16665 2/20 0.44
HSD17B10 Q99714 1/20 0.44
SERPINE1 P05121 1/20 0.32
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL8202340 1.00 THRB (0.48) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL8201724 0.92 THRB (0.43) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL22985816 0.89 THRB (0.46) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL18873594 0.89 THRB (0.41) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL26111850 0.87 THRB (0.68) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL31377967 0.81 THRB (0.41) THRBTSHRALDH1A1KMT2A
SCHEMBL8201795 0.80 TSHR (0.52) THRBTSHRALDH1A1
SCHEMBL5946541 0.80
SCHEMBL3843945 0.79 THRB (0.34) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL21266399 0.78

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