SCHEMBL18925441

SCHEMBL18925441

C=CS(=O)(=O)OCn1c(=O)n(COC)c(=O)n(COS(=O)(=O)C=C)c1=O

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.33

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
SCHEMBL16004438 0.91 CYP3A4 (0.39) CYP3A4
SCHEMBL18116568 0.84 CYP3A4 (0.32) CYP3A4
SCHEMBL18925450 0.78 CYP3A4 (0.31) CYP3A4
SCHEMBL13383886 0.76 ADORA2B (0.40) CYP3A4
SCHEMBL20990473 0.73 CYP3A4 (0.67) CYP3A4
SCHEMBL15143908 0.73 CYP3A4 (0.67) CYP3A4
SCHEMBL16004436 0.72 CYP3A4 (0.37) CYP3A4
SCHEMBL24404222 0.70 CYP3A4 (0.32) CYP3A4
SCHEMBL21657702 0.69 KDM4E (0.36) CYP3A4
SCHEMBL16004448 0.68 CYP3A4 (0.33) CYP3A4

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-20170162906-A1 NON-AQUEOUS ELECTROLYTIC SOLUTION AND NON-AQUEOUS ELECTROLYTE SECONDARY BATTERY USING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2017-06-08 US disclosed