SCHEMBL9681723

SCHEMBL9681723

O=S(=O)(Oc1cc(OS(=O)(=O)c2ccc(Br)cc2)cc(OS(=O)(=O)c2ccc(Br)cc2)c1)c1ccc(Br)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.47
CA1 P00915 3/20 0.47
CA9 Q16790 3/20 0.47
PLCG1 P19174 1/20 0.45
TDP1 Q9NUW8 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CA12 O43570 2/20 0.42
MMP1 P03956 1/20 0.42
MMP2 P08253 1/20 0.42
MMP9 P14780 1/20 0.42
MMP8 P22894 1/20 0.42
MMP13 P45452 1/20 0.42
APEX1 P27695 1/20 0.42
CYP1A1 P04798 1/20 0.41
GAA P10253 1/20 0.40
MAPK1 P28482 1/20 0.40
CA7 P43166 1/20 0.40

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
SCHEMBL18359535 0.82 CA2 (0.41) CA2CA1CA9TDP1L3MBTL1
SCHEMBL4195648 0.80 MEN1 (0.53) CA2CA1CA9LMNAHTT
SCHEMBL2886403 0.80 CA2 (0.46) CA2CA1CA9PLCG1TDP1
SCHEMBL18359536 0.80 MEN1 (0.53) CA2CA1CA9LMNAHTT
SCHEMBL11091725 0.80 CA2 (0.46) CA2CA1CA9TDP1L3MBTL1
SCHEMBL27428841 0.79 TDP1 (0.67) CA2CA1CA9TDP1L3MBTL1
SCHEMBL5083041 0.78 MEN1 (0.58) CA2CA1CA9TDP1L3MBTL1
SCHEMBL926461 0.78 CA12 (0.51) CA2CA1CA9TDP1L3MBTL1
SCHEMBL8602840 0.77 TDP1 (0.54) CA2CA1CA9TDP1L3MBTL1
SCHEMBL8599495 0.77 TDP1 (0.54) CA2CA1CA9TDP1L3MBTL1

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-0510441-A1 Positive-working radiation-sensitive composition and radiation-sensitive recording material produced therewith HOECHST AKTIENGESELLSCHAFT (DE) 1992-10-28 EP disclosed