SCHEMBL27871879

SCHEMBL27871879

O=C(NO)c1ccccc1OS(=O)(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LIG1 P18858 1/20 0.51
▸ GAA P10253 2/20 0.48
▸ KDM4E B2RXH2 2/20 0.48
▸ MPO P05164 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ HIF1A Q16665 1/20 0.48
▸ MMP3 P08254 5/20 0.44
▸ HDAC8 Q9BY41 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ MMP2 P08253 6/20 0.43
▸ MMP13 P45452 6/20 0.43
▸ MMP9 P14780 5/20 0.43
▸ MMP8 P22894 5/20 0.43
▸ MMP12 P39900 5/20 0.43
▸ MMP14 P50281 5/20 0.43
▸ MMP16 P51512 5/20 0.43
▸ LMNA P02545 1/20 0.43

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
SCHEMBL26647 0.79 KDM4E (0.53) KDM4ESMN1; SMN2L3MBTL1MEN1KMT2A
SCHEMBL29157638 0.79 KDM4E (0.54) KDM4EL3MBTL1MEN1KMT2AMMP2
SCHEMBL27480641 0.79 L3MBTL1 (0.69) GAAKDM4EL3MBTL1MEN1POLB
Water SCHEMBL3696220 0.78 KDM4E (0.52) KDM4ESMN1; SMN2L3MBTL1MEN1KMT2A
SCHEMBL2702291 0.78 KDM4E (0.52) KDM4ESMN1; SMN2L3MBTL1MEN1KMT2A
SCHEMBL6812015 0.78 KDM4E (0.52) KDM4ESMN1; SMN2L3MBTL1MEN1KMT2A
SCHEMBL8577256 0.78 LMNA (0.51) KDM4ESMN1; SMN2L3MBTL1MEN1POLB
SCHEMBL10335126 0.78 L3MBTL1 (0.50) KDM4ESMN1; SMN2L3MBTL1MEN1POLB
SCHEMBL6567089 0.78 KDM4E (0.52) KDM4EL3MBTL1MEN1KMT2ALMNA
Phthalic Acid SCHEMBL8994216 0.78 ALDH1A1 (0.54) KDM4ESMN1; SMN2L3MBTL1MEN1KMT2A

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-102482231-A Sulfonic amide and sulfoximine-substituted diaryl-dihydropyrimidinones and usage thereof Bayer Pharma AG 2012-05-30 — — CN claimed
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