SCHEMBL8732244

SCHEMBL8732244

O=[PH](O)COS(=O)(=O)c1ccccc1C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
HSD11B1 P28845 1/20 0.40
SLC22A12 Q96S37 10/20 0.39
ALDH1A1 P00352 2/20 0.39
RAB9A P51151 1/20 0.39
MMP7 P09237 1/20 0.38
KAT6A Q92794 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
F2 P00734 2/20 0.36
CYP2C9 P11712 1/20 0.35
SLC22A6 Q4U2R8 1/20 0.35
SLC22A8 Q8TCC7 1/20 0.35
SLC22A11 Q9NSA0 1/20 0.35

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
SCHEMBL8731975 0.88 HSD11B1 (0.33) MEN1KMT2AHSD11B1ALDH1A1
SCHEMBL8762711 0.85 MEN1 (0.43) MEN1KMT2AHSD11B1SLC22A12ALDH1A1
SCHEMBL8854529 0.82 MEN1 (0.41) MEN1KMT2AHSD11B1SLC22A12ALDH1A1
SCHEMBL8734639 0.81 IDO1 (0.37) HSD11B1
SCHEMBL29449482 0.80 MEN1 (0.50) MEN1KMT2AHSD11B1SLC22A12ALDH1A1
SCHEMBL6115152 0.80 MEN1 (0.50) MEN1KMT2AHSD11B1SLC22A12ALDH1A1
SCHEMBL8732648 0.79 SLC22A12 (0.39) SLC22A12F2
SCHEMBL27466909 0.79 MEN1 (0.43) MEN1KMT2AHSD11B1SLC22A12ALDH1A1
SCHEMBL8730124 0.78 SLC22A12 (0.34) HSD11B1SLC22A12KAT6A
SCHEMBL8735591 0.78 FFAR4 (0.35) ALDH1A1

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