SCHEMBL2995889

SCHEMBL2995889

O=C(CCP(=O)(O)O)C(C(F)(F)F)C(F)(F)F

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PGK1 P00558 1/20 0.37
PGK2 P07205 1/20 0.37
TYMS P04818 1/20 0.35
FOLH1 Q04609 1/20 0.34
ALDH1A1 P00352 1/20 0.32
GRM4 Q14833 1/20 0.31
ANPEP P15144 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
SCHEMBL13274641 0.83 PGK1 (0.35) PGK1PGK2TYMSFOLH1ALDH1A1
SCHEMBL2988768 0.77 TSHR (0.40) PGK1PGK2
SCHEMBL2990048 0.75 FOLH1 (0.36) PGK1PGK2TYMSFOLH1ALDH1A1
SCHEMBL2988737 0.70 ALDH1A1 (0.41) TYMSFOLH1ALDH1A1ANPEP
SCHEMBL2991836 0.67 FOLH1 (0.39) TYMSFOLH1ALDH1A1ANPEP
SCHEMBL2988837 0.64 PGK1 (0.32) PGK1PGK2
SCHEMBL2990569 0.64 FDPS (0.46) FOLH1
SCHEMBL2989915 0.63 FOLH1 (0.36) TYMSFOLH1ALDH1A1
SCHEMBL23648 0.63
SCHEMBL242285 0.61 TYMS (0.53) TYMSFOLH1ALDH1A1GRM4ANPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8962192-B2 Nonaqueous electrolytic solution and nonaqueous electrolyte battery MITSUBISHI CHEMICAL CORPORATION (JP) 2015-02-24 US disclosed
US-8574757-B2 Nonaqueous electrolytic solution and nonaqueous electrolyte battery MITSUBISHI CHEMICAL CORPORATION (JP) 2013-11-05 US disclosed
US-20120264011-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2012-10-18 US disclosed
US-20100035147-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2010-02-11 US disclosed