SCHEMBL9303799

SCHEMBL9303799

O=C1OCC(COS(=O)(=O)c2ccc([N+](=O)[O-])cc2)O1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.53
WDR77 Q9BQA1 1/20 0.53
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
PARL Q9H300 1/20 0.38
ACHE P22303 1/20 0.37
CA1 P00915 5/20 0.37
CA2 P00918 5/20 0.37
CA9 Q16790 4/20 0.37
CA12 O43570 3/20 0.37
CA14 Q9ULX7 3/20 0.37
CA3 P07451 2/20 0.37
CA4 P22748 2/20 0.37
CA6 P23280 2/20 0.37
CA5A P35218 2/20 0.37
CA7 P43166 2/20 0.37
CA13 Q8N1Q1 2/20 0.37
CA5B Q9Y2D0 2/20 0.37
ALPL P05186 1/20 0.36
ALPI P09923 1/20 0.36

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
SCHEMBL9303794 1.00 PRMT5 (0.53) PRMT5WDR77MEN1KMT2APARL
SCHEMBL9304964 0.87 PRMT5 (0.74) PRMT5WDR77MEN1KMT2AACHE
SCHEMBL9304971 0.87 PRMT5 (0.74) PRMT5WDR77MEN1KMT2AACHE
SCHEMBL9645456 0.83 PRMT5 (0.72) PRMT5WDR77PARLACHECA1
SCHEMBL2967442 0.83 PRMT5 (0.72) PRMT5WDR77PARLACHECA1
SCHEMBL1164097 0.83 PRMT5 (0.72) PRMT5WDR77PARLACHECA1
SCHEMBL9305032 0.82 ALDH1A1 (0.48) PRMT5WDR77MEN1KMT2ACA1
SCHEMBL9305625 0.82 ALDH1A1 (0.48) PRMT5WDR77MEN1KMT2ACA1
SCHEMBL9546855 0.81 PRMT5 (0.44) PRMT5WDR77MEN1KMT2AACHE
SCHEMBL9304736 0.81 PRMT5 (0.44) PRMT5WDR77MEN1KMT2AACHE

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-5326885-A Process of preparing enriched enantiomers of glycerol carbonate and derivatives thereof for synthesis of β-blockers COGNIS, INC. (US) 1994-07-05 US claimed
US-5326885-A Process of preparing enriched enantiomers of glycerol carbonate and derivatives thereof for synthesis of β-blockers COGNIS, INC. (US) 1994-07-05 US disclosed