SCHEMBL18176773

SCHEMBL18176773

CCCS(=O)(=O)OCCC#N

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 1/20 0.41
TSHR P16473 1/20 0.36
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32

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
SCHEMBL18176768 0.88 TSHR (0.43) NLRP3TSHRCA1CA2
SCHEMBL18176766 0.88 TSHR (0.43) NLRP3TSHRCA1CA2
SCHEMBL18176765 0.85 NLRP3 (0.41) NLRP3TSHRCA1CA2
SCHEMBL26299436 0.81 NLRP3 (0.38) NLRP3TSHRCA2
SCHEMBL4710589 0.79 CA1 (0.42) TSHRCA1CA2
SCHEMBL577078 0.79 CA2 (0.52) CA1CA2
SCHEMBL9082743 0.79 LOX (0.39) NLRP3CA2
SCHEMBL18176770 0.79 TSHR (0.46) NLRP3TSHRCA1CA2
SCHEMBL18176772 0.78 NLRP3 (0.34) NLRP3CA1CA2
SCHEMBL27534415 0.78 LOX (0.37) NLRP3CA2

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
US-10243242-B2 Electrolytic solution, electrochemical device, lithium-ion secondary cell, and module DAIKIN INDUSTRIES, LTD. (JP) 2019-03-26 US disclosed
US-20160315354-A1 ELECTROLYTIC SOLUTION, ELECTROCHEMICAL DEVICE, LITHIUM-ION SECONDARY CELL, AND MODULE DAIKIN INDUSTRIES, LTD. (JP) 2016-10-27 US disclosed