SCHEMBL2988528

SCHEMBL2988528

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

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.33
TSHR P16473 3/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
HIF1A Q16665 1/20 0.32
MEN1 O00255 1/20 0.31
GAA P10253 1/20 0.31
PKM P14618 1/20 0.31
KMT2A Q03164 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
SCHEMBL2990307 0.75 ALDH1A1 (0.36) ALDH1A1TSHRMAPTHPGDMAPK1
SCHEMBL2986490 0.74
SCHEMBL2982572 0.72 ALDH1A1 (0.38) ALDH1A1TSHRCYP2D6CYP2C19HIF1A
SCHEMBL2986483 0.71 ALDH1A1 (0.33) ALDH1A1TSHRMAPTHPGDMAPK1
SCHEMBL1683251 0.71 TSHR (0.37) ALDH1A1TSHRSMN1; SMN2CYP2C19
SCHEMBL15438090 0.69
SCHEMBL2989631 0.68 GRM2 (0.31) ALDH1A1MAPTHPGDMAPK1SMN1; SMN2
Trifluoroacetic Acid SCHEMBL31031817 0.64 FAAH (0.42) ALDH1A1TSHRSMN1; SMN2CYP2D6CYP2C19
SCHEMBL25518775 0.64 ALDH1A1 (0.37) ALDH1A1TSHRMAPTHPGDMAPK1
Trifluoroacetic Acid SCHEMBL27841664 0.64 FAAH (0.42) ALDH1A1TSHRSMN1; SMN2CYP2D6CYP2C19

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