SCHEMBL27366575

SCHEMBL27366575

O=S(=O)(Oc1ccccc1)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F.[KH]

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.44
PIK3CA P42336 1/20 0.44
PIK3CB P42338 1/20 0.44
CA2 P00918 15/20 0.44
CA1 P00915 14/20 0.44
CA9 Q16790 3/20 0.44
KMT2A Q03164 2/20 0.39
JAK2 O60674 1/20 0.37
JAK3 P52333 1/20 0.37
PTK2 Q05397 1/20 0.37
LMNA P02545 1/20 0.37
PPARG P37231 1/20 0.37
NFE2L2 Q16236 1/20 0.37
MMP1 P03956 2/20 0.37
MMP2 P08253 2/20 0.37
MMP9 P14780 2/20 0.37
MMP8 P22894 2/20 0.37
MMP13 P45452 2/20 0.37
MEN1 O00255 1/20 0.36

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
SCHEMBL6479936 0.98 CA2 (0.45) PIK3CDPIK3CAPIK3CBCA2CA1
Iodide SCHEMBL5315919 0.96 PIK3CD (0.44) PIK3CDPIK3CAPIK3CBCA2CA1
SCHEMBL6900759 0.96 CA2 (0.46) PIK3CDPIK3CAPIK3CBCA2CA1
SCHEMBL28289623 0.95 CA2 (0.45) PIK3CDPIK3CAPIK3CBCA2CA1
SCHEMBL575913 0.88 CA2 (0.51) PIK3CDPIK3CAPIK3CBCA2CA1
SCHEMBL7045992 0.88 CA2 (0.51) PIK3CDPIK3CAPIK3CBCA2CA1
SCHEMBL6474468 0.86 CA2 (0.50) PIK3CDPIK3CAPIK3CBCA2CA1
Diphenylsulfane SCHEMBL1772327 0.85 PIK3CD (0.45) PIK3CDPIK3CAPIK3CBCA2CA1
SCHEMBL2572784 0.84 STS (0.45) PIK3CDPIK3CAPIK3CBCA2CA1
SCHEMBL548130 0.84 PIK3CD (0.42) PIK3CDPIK3CAPIK3CBCA2CA1

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
CN-1052021-C Stabilised, flame resistant polycarbonate moulding compounds BAYER AG (DE) 2000-05-03 CN disclosed