SCHEMBL8734612

SCHEMBL8734612

CCOP(=O)(COS(=O)(=O)c1c(CC)cccc1OC(F)(F)F)OC(C)C

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KCNK3 O14649 2/20 0.31
KCNK9 Q9NPC2 2/20 0.31
EPHX2 P34913 1/20 0.31
PPARG P37231 1/20 0.31
F2R P25116 1/20 0.30

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
SCHEMBL8732405 0.94 KCNK3 (0.33) KCNK3KCNK9EPHX2PPARGF2R
SCHEMBL8735011 0.91 PPARG (0.31) EPHX2PPARGF2R
SCHEMBL8731844 0.91 KCNK3 (0.32) KCNK3KCNK9PPARGF2R
SCHEMBL8732271 0.90 KCNK3 (0.31) KCNK3KCNK9F2R
SCHEMBL8732699 0.86 KCNK3 (0.33) KCNK3KCNK9EPHX2PPARGF2R
SCHEMBL8732897 0.86 PPARG (0.33) KCNK3KCNK9EPHX2PPARGF2R
SCHEMBL8730154 0.85 EPHX2 (0.31) EPHX2PPARG
SCHEMBL8734994 0.84 CA12 (0.34)
SCHEMBL8734796 0.82 FFAR4 (0.33)
SCHEMBL8732363 0.81 KCNK3 (0.34) KCNK3KCNK9F2R

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