SCHEMBL11513373

SCHEMBL11513373

COC(=O)c1ccc(S(=O)(=O)Cl)[nH]1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.50
GLA P06280 2/20 0.50
KDM4E B2RXH2 1/20 0.50
CYP1A2 P05177 1/20 0.40
MAPK1 P28482 1/20 0.36
MAPT P10636 1/20 0.36
LMNA P02545 1/20 0.35
PPARG P37231 1/20 0.35
NCOA2 Q15596 1/20 0.35
NCOA1 Q15788 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
NCOA3 Q9Y6Q9 1/20 0.35
FBP1 P09467 1/20 0.35
NR4A2 P43354 1/20 0.35
TSHR P16473 1/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CA9 Q16790 2/20 0.34
CA5A P35218 1/20 0.34
STS P08842 1/20 0.34

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
SCHEMBL70624 0.78 GAA (0.67) GAAGLAKDM4ECYP1A2MAPK1
SCHEMBL1742098 0.75 GAA (0.46) GAAGLAKDM4ECYP1A2MAPK1
SCHEMBL4674954 0.73 GAA (0.56) GAAGLAKDM4ECYP1A2MAPK1
SCHEMBL8108947 0.72 GAA (0.55) GAAGLAKDM4ECYP1A2MAPK1
SCHEMBL13804463 0.71 GAA (0.58) GAAGLAKDM4ECYP1A2MAPK1
SCHEMBL1422945 0.71 KDM4E (0.58) GAAGLAKDM4ECYP1A2MAPK1
SCHEMBL3551459 0.71 GAA (0.58) GAAGLAKDM4ECYP1A2MAPK1
SCHEMBL9918755 0.69 GAA (0.56) GAAGLAKDM4ECYP1A2MAPK1
SCHEMBL1197055 0.69 GAA (0.56) GAAGLAKDM4ECYP1A2MAPK1
SCHEMBL17241127 0.69 GAA (0.56) GAAGLAKDM4ECYP1A2MAPK1

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
US-4136253-A ANTIBIOTICS PFIZER INC. (US) 1979-01-23 US disclosed