SCHEMBL7450429

SCHEMBL7450429

O=C(O)ON1C(=O)CCC1=O.O=S1(=O)CCCC1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 2/20 0.31
PARL Q9H300 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
SCHEMBL57128 0.84 PARL (0.38) MGLLPARL
Bicarbonate SCHEMBL28277654 0.82 MGLL (0.36) MGLLPARL
SCHEMBL15321160 0.80 MGLL (0.36) MGLLPARL
Hno SCHEMBL15321628 0.80 MGLL (0.36) MGLLPARL
Methylene Chloride SCHEMBL28985432 0.76 MGLL (0.36) MGLLPARL
Ethylene Glycol SCHEMBL2577550 0.76 MGLL (0.34) MGLLPARL
Oxirane SCHEMBL7945897 0.76 MGLL (0.35) MGLLPARL
Cyclooctene SCHEMBL1299545 0.74 MGLL (0.34) MGLLPARL
Cyclooctene SCHEMBL1299542 0.74 MGLL (0.34) MGLLPARL
SCHEMBL28418116 0.71 KDM4E (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0744948-A4 PROTEASE INHIBITORS LILLY CO ELI (US) 1997-06-11 EP disclosed
EP-0744948-A1 PROTEASE INHIBITORS ELI LILLY AND COMPANY (US) 1996-12-04 EP disclosed
WO-1995020962-A1 PROTEASE INHIBITORS ELI LILLY AND COMPANY (US) 1995-08-10 WO disclosed