SCHEMBL8735693

SCHEMBL8735693

CCOP(=O)(COS(=O)(=O)c1c(F)cccc1OC(F)(F)F)OCC

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KAT6A Q92794 2/20 0.33
HCRTR1 O43613 12/20 0.32
HCRTR2 O43614 12/20 0.32
F2R P25116 1/20 0.31
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 1/20 0.30
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
GAA P10253 1/20 0.30
KMT2A Q03164 1/20 0.30
KCNN4 O15554 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
SCHEMBL8732271 0.91 KCNK3 (0.31) KAT6AF2R
SCHEMBL8735011 0.88 PPARG (0.31) HCRTR1HCRTR2F2RMEN1LMNA
SCHEMBL8732363 0.85 KCNK3 (0.34) HCRTR1HCRTR2F2R
SCHEMBL8732902 0.83 PTGES2 (0.34) KAT6ACA12CA1CA2CA9
SCHEMBL8734581 0.83 GAA (0.34) KAT6AHCRTR1HCRTR2F2RGAA
SCHEMBL8729986 0.82 KCNK3 (0.32)
SCHEMBL8732694 0.81 CA12 (0.35) KAT6ACA12CA1CA2CA9
SCHEMBL8732023 0.81 KCNK3 (0.33) HCRTR1HCRTR2F2R
SCHEMBL8734612 0.80 KCNK3 (0.31) F2R
SCHEMBL8735685 0.80 TSHR (0.30)

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