SCHEMBL28098554

SCHEMBL28098554

FC(F)(F)Oc1ccccc1C(F)(C(F)(F)F)C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.42
RXRA P19793 2/20 0.40
RXRB P28702 2/20 0.40
RXRG P48443 2/20 0.40
TRPA1 O75762 2/20 0.39
TRPM8 Q7Z2W7 1/20 0.39
TRPV1 Q8NER1 1/20 0.39
GAA P10253 1/20 0.37
ALDH1A1 P00352 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
EPHX2 P34913 1/20 0.35
KIF11 P52732 1/20 0.34
SCN9A Q15858 2/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34
POLB P06746 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
S1PR1 P21453 1/20 0.33
SLC22A12 Q96S37 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
SCHEMBL9242571 0.81 HSD11B1 (0.53) HSD11B1RXRARXRBRXRGTRPA1
SCHEMBL4654446 0.80 RXRA (0.47) HSD11B1RXRARXRBRXRGTRPA1
SCHEMBL6371363 0.77 TDP1 (0.47) HSD11B1RXRARXRBRXRGGAA
SCHEMBL2090915 0.74 HSD11B1 (0.40) HSD11B1RXRARXRBRXRGTRPA1
SCHEMBL2090917 0.74 HSD11B1 (0.40) HSD11B1RXRARXRBRXRGTRPA1
SCHEMBL16579384 0.74 HSD11B1 (0.44) HSD11B1RXRARXRBRXRGTRPA1
SCHEMBL7701143 0.73 ALDH1A1 (0.50) HSD11B1TRPA1ALDH1A1L3MBTL1SCN9A
SCHEMBL30707956 0.72 RXRA (0.47) HSD11B1RXRARXRBRXRGGAA
SCHEMBL17420774 0.72 RXRA (0.47) HSD11B1RXRARXRBRXRGGAA
SCHEMBL27660142 0.72 HSD11B1 (0.62) HSD11B1TRPA1TRPM8TRPV1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105873908-A Novel compounds for combating arthropods 拜耳作物科学股份公司 2016-08-17 CN disclosed