SCHEMBL9795176

SCHEMBL9795176

C=CCOC(=O)N1C[C@@H](SC(C)=O)C[C@H]1COCCO

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ECE1 P42892 1/20 0.38

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
SCHEMBL9794941 0.92 ECE1 (0.41) ECE1
SCHEMBL9795018 0.87 ECE1 (0.38) ECE1
SCHEMBL7805577 0.86 ECE1 (0.33) ECE1
SCHEMBL9520505 0.86 ECE1 (0.35) ECE1
SCHEMBL9794970 0.84 ECE1 (0.40) ECE1
SCHEMBL9429313 0.83 ECE1 (0.34) ECE1
SCHEMBL9519054 0.82 ECE1 (0.35) ECE1
SCHEMBL8832600 0.80 ECE1 (0.32) ECE1
SCHEMBL10699527 0.79 ECE1 (0.33) ECE1
SCHEMBL8805757 0.78 SIGMAR1 (0.33)

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-4983596-A Microbiocides; for treatment of infectious diseases FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1991-01-08 US disclosed
EP-0341557-A1 3-pyrrolidinylthio-1-azabicyclo(3.2.0)-hept-2-ene-2-carboxylic acid derivatives and their preparation FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-11-15 EP disclosed