SCHEMBL10072970

SCHEMBL10072970

C[C@H](c1ccc(NS(C)(=O)=O)cc1)S(=O)(=O)NCCCN(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.43
KDM4E B2RXH2 3/20 0.43
ADRB2 P07550 2/20 0.43
ADRB1 P08588 2/20 0.43
ADRB3 P13945 2/20 0.43
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
GLA P06280 1/20 0.42
BLM P54132 1/20 0.42
CA12 O43570 2/20 0.42
CA2 P00918 2/20 0.42
CA9 Q16790 2/20 0.42
CACNA1F O60840 2/20 0.41
CHRM2 P08172 2/20 0.41
DRD3 P35462 2/20 0.41
CACNA1D Q01668 2/20 0.41
KCNH2 Q12809 2/20 0.41
CACNA1S Q13698 2/20 0.41
CACNA1C Q13936 2/20 0.41
ADRA2B P18089 1/20 0.41

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
SCHEMBL688728 1.00 LMNA (0.43) LMNAKDM4EADRB2ADRB1ADRB3
SCHEMBL687741 0.80 CA12 (0.43) LMNAADRB3KMT2ACA12CA2
SCHEMBL688675 0.78 LMNA (0.45) LMNAKDM4EADRB2ADRB1ADRB3
SCHEMBL687288 0.75 CXCR2 (0.44) KMT2ACA12CA2CA9ALOX15
SCHEMBL6460284 0.74 KCNH2 (0.47) LMNAKDM4EKMT2ACA12CA2
SCHEMBL687204 0.74 LMNA (0.52) LMNAKDM4EADRB2ADRB1ADRB3
SCHEMBL687784 0.73 GAA (0.44) LMNAKDM4EKMT2AMEN1CA12
SCHEMBL10072501 0.73 GAA (0.44) LMNAKDM4EKMT2AMEN1CA12
SCHEMBL10532863 0.71 HPGD (0.58) LMNAKDM4ECA12CA2CA9
SCHEMBL9624965 0.70 HPGD (0.56) LMNAKDM4ECA12CA2CA9

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-1606248-B1 SULFONIC ACIDS, THEIR DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM DOMPE SPA (IT) 2012-02-29 EP disclosed