SCHEMBL9696909

SCHEMBL9696909

C=CCOC(=O)NC[C@H](CC(=O)C[C@H]1NC(=O)[C@H]1[C@@H](CO[SiH](C)C)C(C)(C)C)NC(=O)OCC=C

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 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
SCHEMBL9697796 1.00 CASP1 (0.30) CASP1
SCHEMBL9698986 1.00 CASP1 (0.30) CASP1
SCHEMBL9387554 0.86 CASP1 (0.34) CASP1
SCHEMBL9699434 0.86
SCHEMBL9697842 0.86
SCHEMBL9697789 0.80 CASP1 (0.31) CASP1
SCHEMBL9698972 0.80 CASP1 (0.31) CASP1
SCHEMBL9696898 0.80 CASP1 (0.31) CASP1
SCHEMBL9698968 0.80 CASP1 (0.31) CASP1
SCHEMBL9697787 0.80 CASP1 (0.31) CASP1

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
WO-1992002521-A1 1-AZABICYCLO[3.2.0]HEPT-2-ENE-2-CARBOXYLIC ACID COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-02-20 WO disclosed