SCHEMBL10656084

SCHEMBL10656084

CC(O)NS(=O)(=O)c1cccc([N+](=O)[O-])c1C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.51
▸ TDP1 Q9NUW8 2/20 0.51
▸ THRB P10828 1/20 0.45
▸ CA1 P00915 1/20 0.44
▸ CA2 P00918 1/20 0.44
▸ MMP1 P03956 1/20 0.44
▸ MMP2 P08253 1/20 0.44
▸ MMP9 P14780 1/20 0.44
▸ MMP8 P22894 1/20 0.44
▸ MMP13 P45452 1/20 0.44
▸ ADAMTS4 O75173 1/20 0.43
▸ PKM P14618 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ F2 P00734 2/20 0.40
▸ PRSS1 P07477 2/20 0.40
▸ PRSS2 P07478 2/20 0.40
▸ PRSS3 P35030 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ MEN1 O00255 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
SCHEMBL10652008 0.87 SLC10A6 (0.46) L3MBTL1TDP1THRBCA1CA2
SCHEMBL8661200 0.77 TDP1 (0.58) L3MBTL1TDP1THRBCA1CA2
SCHEMBL10656087 0.76 KMT2A (0.50) L3MBTL1TDP1THRBCA1CA2
SCHEMBL9620989 0.76 TDP1 (0.57) L3MBTL1TDP1THRBCA1CA2
SCHEMBL563639 0.76 TDP1 (0.57) L3MBTL1TDP1THRBCA1CA2
SCHEMBL10570435 0.75 ALDH1A1 (0.48) L3MBTL1TDP1THRBCA1CA2
SCHEMBL10873626 0.74 SLC10A6 (0.43) L3MBTL1TDP1THRBCA1CA2
SCHEMBL5638270 0.74 CA1 (0.59) L3MBTL1TDP1THRBCA1CA2
SCHEMBL11527174 0.74 CA1 (0.59) L3MBTL1TDP1THRBCA1CA2
SCHEMBL5638275 0.74 CA1 (0.59) L3MBTL1TDP1THRBCA1CA2

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-0197386-B1 2-(SUBSTITUTED SULFAMYL) DERIVATIVES OF 6-NITROBENZOIC ACID, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM MERCK & CO. INC. (US) 1988-11-02 — — EP claimed
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