SCHEMBL20520294

SCHEMBL20520294

C[N+](C)(CCCS(=O)(=O)[O-])CC1COc2cscc2O1

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BBOX1 O75936 2/20 0.39
LMNA P02545 1/20 0.31
CA2 P00918 1/20 0.30

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
SCHEMBL20520295 0.85 BBOX1 (0.35) BBOX1
SCHEMBL20520303 0.84 BBOX1 (0.34) BBOX1
SCHEMBL20520299 0.83 BBOX1 (0.33) BBOX1
SCHEMBL20520301 0.83 BBOX1 (0.33) BBOX1
Potassium Ion SCHEMBL17272197 0.81 CA2 (0.37) LMNACA2
Lithium Ion SCHEMBL17272156 0.80 CA2 (0.36) LMNACA2
SCHEMBL17272180 0.80 CA2 (0.36) LMNACA2
Potassium Ion SCHEMBL29780202 0.79 CA2 (0.36) LMNACA2
Potassium Ion SCHEMBL17272229 0.79 CA2 (0.36) LMNACA2
Potassium Ion SCHEMBL17272203 0.78 CA2 (0.39) LMNACA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10689484-B2 Method for electropolymerization of hydrophilic EDOT monomers in an aqueous solution THE UNIVERSITY OF AKRON (US) 2020-06-23 US claimed
US-20180282472-A1 METHOD FOR ELECTROPOLYMERIZATION OF HYDROPHILIC EDOT MONOMERS IN AN AQUEOUS SOLUTION NATIONAL SCIENCE FOUNDATION 2018-10-04 US claimed
US-10689484-B2 Method for electropolymerization of hydrophilic EDOT monomers in an aqueous solution THE UNIVERSITY OF AKRON (US) 2020-06-23 US disclosed
US-20180282472-A1 METHOD FOR ELECTROPOLYMERIZATION OF HYDROPHILIC EDOT MONOMERS IN AN AQUEOUS SOLUTION NATIONAL SCIENCE FOUNDATION 2018-10-04 US disclosed