SCHEMBL9696898

SCHEMBL9696898

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

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 2/20 0.31

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
SCHEMBL9697789 1.00 CASP1 (0.31) CASP1
SCHEMBL9698972 1.00 CASP1 (0.31) CASP1
SCHEMBL9387545 0.86 CASP1 (0.36) CASP1
SCHEMBL9699424 0.85
SCHEMBL9697825 0.85
SCHEMBL9313354 0.84
SCHEMBL9428005 0.83 TDP1 (0.30)
SCHEMBL9697796 0.80 CASP1 (0.30) CASP1
SCHEMBL9698986 0.80 CASP1 (0.30) CASP1
SCHEMBL9696909 0.80 CASP1 (0.30) 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