SCHEMBL20008867

SCHEMBL20008867

CC(OC(=O)c1ccc(C(=O)OC(CS(=O)(=O)O)C(F)(F)F)s1)C(C)(F)F

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
NPSR1 Q6W5P4 2/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
LMNA P02545 1/20 0.31
PPARG P37231 1/20 0.31
NCOA2 Q15596 1/20 0.31
NCOA1 Q15788 1/20 0.31
NCOA3 Q9Y6Q9 1/20 0.31
PRSS1 P07477 2/20 0.31
TMPRSS15 P98073 2/20 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
SCHEMBL20008836 0.86 CA1 (0.36)
SCHEMBL20008938 0.83 HDAC4 (0.36) HDAC4HDAC6L3MBTL1PRSS1TMPRSS15
SCHEMBL20008919 0.83 MMP1 (0.33)
SCHEMBL20008839 0.81 GABRA1 (0.35) HPGD
SCHEMBL20008868 0.81 GABRA1 (0.33)
SCHEMBL20008920 0.78
SCHEMBL20008935 0.75
SCHEMBL18775682 0.74 TSHR (0.41) TSHRLMNA
SCHEMBL18891092 0.72 KMT2A (0.36) MAPK1
SCHEMBL18775874 0.72 UTS2R (0.38) L3MBTL1LMNAPRSS1

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
US-20180085019-A1 ADHESIVE COMPOSITION, BIO-ELECTRODE, AND METHOD FOR MANUFACTURING A BIO-ELECTRODE SHIN-ETSU CHEMICAL CO., LTD. (JP) 2018-03-29 US disclosed