SCHEMBL8854450

SCHEMBL8854450

O=[PH](O)OCOS(=O)(=O)c1c(F)cccc1C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGES2 Q9H7Z7 1/20 0.33
SLC22A12 Q96S37 1/20 0.33
STIM1 Q13586 1/20 0.32
ORAI1 Q96D31 1/20 0.32
KAT6A Q92794 1/20 0.32
PTGS2 P35354 1/20 0.31
HSD11B1 P28845 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
SCHEMBL27449557 0.89 SLC22A12 (0.34) PTGES2SLC22A12STIM1ORAI1KAT6A
SCHEMBL8854428 0.86 SCN8A (0.33)
SCHEMBL8854651 0.85 GABRA1 (0.36)
SCHEMBL8730124 0.84 SLC22A12 (0.34) PTGES2SLC22A12STIM1ORAI1KAT6A
SCHEMBL8854411 0.84 ATM (0.37)
SCHEMBL27362599 0.84 MAOB (0.34)
SCHEMBL8854453 0.83 ALDH1A1 (0.32)
SCHEMBL8854437 0.82 HCRTR1 (0.31)
SCHEMBL8854716 0.82 KCNK3 (0.39)
SCHEMBL8854692 0.81 FFAR4 (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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1173282-A Herbicidal method utilizing phosphosulfonate herbicides and oxime ether safeners ROHM & HAAS (US) 1998-02-18 CN claimed
US-5693590-A PLANT GROWTH REGULATOR ROHM AND HAAS COMPANY (US) 1997-12-02 US claimed
CN-1133120-A Combination containing phosphine sulfonate ester herbicide and dichloro acetamide safety agent ROHM & HAAS (US) 1996-10-16 CN claimed