SCHEMBL28375830

SCHEMBL28375830

Nc1cc(C(F)C(F)(F)C(F)(F)F)ccc1C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.53
ALDH1A1 P00352 8/20 0.53
HSD17B10 Q99714 6/20 0.53
HPGD P15428 5/20 0.53
TDP1 Q9NUW8 7/20 0.41
CYP3A4 P08684 2/20 0.41
ALOX15 P16050 1/20 0.41
PPM1B O75688 1/20 0.40
KMT2A Q03164 6/20 0.39
MEN1 O00255 5/20 0.39
CYP2C9 P11712 3/20 0.39
CYP2C19 P33261 2/20 0.39
CYP2D6 P10635 1/20 0.39
GRM8 O00222 1/20 0.39
GRM6 O15303 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
DRD3 P35462 1/20 0.39
GRM4 Q14833 1/20 0.39
IDO1 P14902 1/20 0.38

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
SCHEMBL28376265 0.88 KEAP1 (0.49) KDM4EALDH1A1HSD17B10HPGDTDP1
SCHEMBL873526 0.85 HSD17B10 (0.50) KDM4EALDH1A1HSD17B10HPGDTDP1
SCHEMBL9833968 0.85 HSD17B10 (0.50) KDM4EALDH1A1HSD17B10HPGDTDP1
SCHEMBL28900515 0.84 HSD17B10 (0.49) KDM4EALDH1A1HSD17B10HPGDTDP1
Hydrochloric Acid SCHEMBL28444882 0.84 HSD17B10 (0.49) KDM4EALDH1A1HSD17B10HPGDTDP1
Water SCHEMBL8588310 0.84 HSD17B10 (0.49) KDM4EALDH1A1HSD17B10HPGDTDP1
SCHEMBL23005781 0.79 ALDH1A1 (0.57) KDM4EALDH1A1HSD17B10HPGDTDP1
SCHEMBL4424759 0.78 ALDH1A1 (0.36) ALDH1A1TDP1CYP3A4ALOX15KMT2A
SCHEMBL27770934 0.77 KMT2A (0.41) KDM4EALDH1A1HSD17B10TDP1PPM1B
SCHEMBL1243946 0.77 ALDH1A1 (0.52) KDM4EALDH1A1HSD17B10HPGDTDP1

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
CN-110809607-B Resin composition, laminate, method for producing same, electrode, secondary battery, and electric double layer capacitor 东丽株式会社 2022-05-17 CN disclosed
CN-109792019-B Separator for nonaqueous electrolyte battery and nonaqueous electrolyte battery 东丽株式会社 2021-12-03 CN disclosed
CN-108368259-B Resin composition 东丽株式会社 2020-11-20 CN disclosed
CN-110809607-A Resin composition, laminate, method for producing same, electrode, secondary battery, and electric double layer capacitor 东丽株式会社 2020-02-18 CN disclosed