SCHEMBL3885732

SCHEMBL3885732

CCC#CC(=O)CNS(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEP1B Q16820 1/20 0.52
▸ MMP1 P03956 2/20 0.49
▸ ALDH1A1 P00352 5/20 0.46
▸ TSHR P16473 2/20 0.46
▸ NPSR1 Q6W5P4 2/20 0.46
▸ LMNA P02545 2/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ THRB P10828 1/20 0.46
▸ NFKB1 P19838 1/20 0.46
▸ HTR2A P28223 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ ADRA1A P35348 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ CA1 P00915 3/20 0.46
▸ CA2 P00918 3/20 0.46
▸ CA12 O43570 1/20 0.44
▸ CA3 P07451 1/20 0.44
▸ CA4 P22748 1/20 0.44
▸ CA6 P23280 1/20 0.44
▸ CA5A P35218 1/20 0.44

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
SCHEMBL3892574 0.75 MEP1B (0.54) MEP1BMMP1ALDH1A1TSHRNPSR1
SCHEMBL23014305 0.75 MEP1B (0.60) MEP1BMMP1TSHRNPSR1CA1
SCHEMBL28677877 0.74 KDM4E (0.71) MEP1BMMP1ALDH1A1TSHRNPSR1
SCHEMBL6850445 0.73 MEP1B (0.62) MEP1BMMP1ALDH1A1TSHRNPSR1
SCHEMBL23014492 0.72 KMT2A (0.59) MEP1BMMP1ALDH1A1LMNASMN1; SMN2
SCHEMBL6505407 0.72 ALDH1A1 (0.68) MEP1BMMP1ALDH1A1TSHRNPSR1
SCHEMBL5899482 0.72 L3MBTL1 (0.60) MEP1BMMP1ALDH1A1MMP2MMP9
SCHEMBL11708062 0.71 MEP1B (0.68) MEP1BMMP1ALDH1A1TSHRNPSR1
SCHEMBL27548886 0.70 CA1 (0.58) MEP1BMMP1ALDH1A1TSHRNPSR1
SCHEMBL8285177 0.70 MEP1B (0.62) MEP1BMMP1ALDH1A1TSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2013184-A1 SULFONAMIDE COMPOUNDS USEFUL AS EDG RECEPTOR MODULATORS AstraZeneca AB (SE) 2009-01-14 — — EP disclosed
WO-2007129019-A1 SULFONAMIDE COMPOUNDS USEFUL AS EDG RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2007-11-15 — — WO disclosed
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