SCHEMBL8732902

SCHEMBL8732902

CCOP(=O)(COS(=O)(=O)c1c(F)cccc1C(F)(F)F)OCC

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGES2 Q9H7Z7 1/20 0.34
SLC22A12 Q96S37 1/20 0.32
LMNA P02545 2/20 0.31
GAA P10253 2/20 0.31
KAT6A Q92794 2/20 0.31
KMT2A Q03164 2/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
MEN1 O00255 1/20 0.31
KDM4E B2RXH2 3/20 0.31
ALDH1A1 P00352 1/20 0.31
HTT P42858 1/20 0.31
KCNK3 O14649 1/20 0.30
KCNK9 Q9NPC2 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
SCHEMBL8732856 0.91 LMNA (0.30) LMNAGAAKMT2ACA12CA1
SCHEMBL8729869 0.88 GABRA1 (0.33) LMNAGAAKMT2AMEN1KDM4E
SCHEMBL8732667 0.88 KDM4E (0.33) LMNAGAAKMT2AMEN1KDM4E
SCHEMBL8734927 0.85 KCNK3 (0.40) LMNAGAAKMT2AMEN1KDM4E
SCHEMBL8729873 0.85 ATM (0.34) LMNAKAT6AKMT2ACA12CA1
SCHEMBL8732002 0.84 STK10 (0.31)
SCHEMBL8734806 0.84 TRPM8 (0.32) PTGES2SLC22A12KAT6A
SCHEMBL8733162 0.83 AR (0.32)
SCHEMBL8732694 0.83 CA12 (0.35) LMNAKAT6ACA12CA1CA2
SCHEMBL8735693 0.83 KAT6A (0.33) LMNAGAAKAT6AKMT2ACA12

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