SCHEMBL8600304

SCHEMBL8600304

CCOC(=O)C(OC)C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.39
HSD17B10 Q99714 3/20 0.37
LMNA P02545 1/20 0.37
ALOX15 P16050 3/20 0.36
MGAM O43451 1/20 0.36
GAA P10253 1/20 0.36
SI P14410 1/20 0.36
MGAM2 Q2M2H8 1/20 0.36
SOAT1 P35610 1/20 0.36
ACHE P22303 1/20 0.35
TRPA1 O75762 1/20 0.33
MAPT P10636 3/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HDAC4 P56524 2/20 0.33
HDAC6 Q9UBN7 2/20 0.33
CYP3A4 P08684 2/20 0.33
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL8595237 0.83 HCAR2 (0.34) ALDH1A1LMNAACHETSHRTDP1
SCHEMBL8597058 0.83 ALDH1A1 (0.39) ALDH1A1HSD17B10LMNAALOX15MGAM
SCHEMBL8598772 0.80 ALDH1A1 (0.45) ALDH1A1LMNAACHESMN1; SMN2TSHR
SCHEMBL8600469 0.79 ACHE (0.45) ALDH1A1ACHEHTTSMN1; SMN2KMT2A
SCHEMBL8860602 0.79 MAPT (0.39) ACHEMAPT
SCHEMBL8599805 0.78 ALDH1A1 (0.34) ALDH1A1HSD17B10LMNAALOX15MGAM
SCHEMBL14715925 0.75 ALDH1A1 (0.43) ALDH1A1HSD17B10LMNAALOX15MGAM
SCHEMBL20473345 0.75 ALDH1A1 (0.43) ALDH1A1HSD17B10LMNAALOX15MGAM
SCHEMBL3407387 0.74 ALDH1A1 (0.34) ALDH1A1HSD17B10LMNAALOX15MGAM
SCHEMBL8599647 0.74 CES2 (0.42) HSD17B10TSHRKMT2A

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-0592669-B1 OPTICALLY ACTIVE TRIFLUOROLACTIC ACID DERIVATIVE AND LIQUID CRYSTAL COMPOSITION CHISSO CORP (JP) 1998-01-28 EP disclosed
US-5665270-A Optically active trifluorolactic acid derivative and liquid crystal composition CHISSO CORPORATION (JP) 1997-09-09 US disclosed
EP-0592669-A1 OPTICALLY ACTIVE TRIFLUOROLACTIC ACID DERIVATIVE AND LIQUID CRYSTAL COMPOSITION CHISSO CORPORATION (JP) 1994-04-20 EP disclosed