SCHEMBL8734756

SCHEMBL8734756

CCOc1cccc(C(F)(F)F)c1S(=O)(=O)OCP(=O)(CC)OC(C)C

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KCNK3 O14649 1/20 0.40
KCNK9 Q9NPC2 1/20 0.40
KDM4E B2RXH2 2/20 0.32
KMT2A Q03164 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
RXFP1 Q9HBX9 3/20 0.32
HSD17B10 Q99714 1/20 0.31
AR P10275 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
SCHEMBL8729954 0.90 CTSS (0.34) KCNK3KCNK9KMT2AL3MBTL1
SCHEMBL8733180 0.90 KCNK3 (0.40) KCNK3KCNK9KDM4EKMT2AL3MBTL1
SCHEMBL8732427 0.89 KCNK3 (0.40) KCNK3KCNK9KDM4EKMT2AL3MBTL1
SCHEMBL8732851 0.87 KCNK3 (0.39) KCNK3KCNK9KDM4EKMT2AL3MBTL1
SCHEMBL8735055 0.87 KCNK3 (0.39) KCNK3KCNK9KDM4EKMT2AL3MBTL1
SCHEMBL8730162 0.85 CTSS (0.32) KMT2AL3MBTL1
SCHEMBL8735717 0.85 SLC6A2 (0.31)
SCHEMBL8734769 0.85 TRPM8 (0.33)
SCHEMBL8732886 0.83 KCNK3 (0.43) KCNK3KCNK9KDM4EKMT2AL3MBTL1
SCHEMBL8735030 0.83 CTSS (0.31)

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
EP-0699390-B1 Compositions containing phosphosulfonate herbicides and dichloroacetamide safeners, and method of use ROHM & HAAS (US) 1998-10-07 EP claimed