SCHEMBL28380686

SCHEMBL28380686

O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1cc(Cl)c(Cl)c(Cl)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.61
▸ GAA P10253 1/20 0.61
▸ L3MBTL1 Q9Y468 1/20 0.56
▸ CA1 P00915 1/20 0.55
▸ CA2 P00918 1/20 0.55
▸ MMP1 P03956 1/20 0.55
▸ MMP2 P08253 1/20 0.55
▸ MMP9 P14780 1/20 0.55
▸ MMP8 P22894 1/20 0.55
▸ MMP13 P45452 1/20 0.55
▸ PKM P14618 2/20 0.54
▸ AR P10275 1/20 0.52
▸ MEN1 O00255 3/20 0.50
▸ KMT2A Q03164 3/20 0.50
▸ CYP19A1 P11511 1/20 0.50
▸ NR1I2 O75469 1/20 0.49
▸ HSPD1 P10809 1/20 0.49
▸ PTPN2 P17706 1/20 0.49
▸ PTPN1 P18031 1/20 0.49
▸ PTPN5 P54829 1/20 0.49

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
SCHEMBL27176695 0.87 SMN1; SMN2 (0.63) SMN1; SMN2GAAL3MBTL1CA1CA2
SCHEMBL27176681 0.85 SMN1; SMN2 (0.64) SMN1; SMN2GAAL3MBTL1CA1CA2
SCHEMBL641243 0.82 SMN1; SMN2 (0.64) SMN1; SMN2GAAL3MBTL1CA1CA2
SCHEMBL410747 0.82 AR (0.67) SMN1; SMN2GAAL3MBTL1CA1CA2
SCHEMBL31235173 0.82 AR (0.67) SMN1; SMN2GAAL3MBTL1CA1CA2
SCHEMBL13602263 0.80 L3MBTL1 (0.63) SMN1; SMN2GAAL3MBTL1CA1CA2
SCHEMBL10642502 0.80 AR (0.50) SMN1; SMN2GAAL3MBTL1CA1CA2
SCHEMBL6534664 0.79 CA1 (0.58) SMN1; SMN2GAAL3MBTL1CA1CA2
SCHEMBL13689981 0.79 SMN1; SMN2 (0.60) SMN1; SMN2GAAL3MBTL1CA1CA2
SCHEMBL5227061 0.78 GAA (0.59) SMN1; SMN2GAAL3MBTL1CA1CA2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114404602-A Solid dispersant of benzamide compound and application thereof 中国医学科学院医药生物技术研究所 2022-04-29 — — CN claimed
CN-114404602-A Solid dispersant of benzamide compound and application thereof 中国医学科学院医药生物技术研究所 2022-04-29 — — CN disclosed
CN-110840836-B Benzamide compound IMB16-4 nano suspension and preparation method thereof 中国医学科学院医药生物技术研究所 2021-11-26 — — CN disclosed
CN-110840836-A Benzamide compound IMB16-4 nano suspension and preparation method thereof 中国医学科学院医药生物技术研究所 2020-02-28 — — CN disclosed
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