SCHEMBL9735134

SCHEMBL9735134

COC(=O)[C@H](CC(C)C)N1CC[C@]2(CCCCN2C(=O)OCc2ccccc2)C1=O

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.38
CTSL P07711 2/20 0.38
CTSK P43235 2/20 0.38
CTSS P25774 1/20 0.38
FKBP1A P62942 1/20 0.37

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
SCHEMBL9735131 1.00 ACE2 (0.38) ACE2CTSLCTSKCTSSFKBP1A
SCHEMBL9734738 0.97
SCHEMBL9736075 0.97
SCHEMBL7618670 0.85 MMP2 (0.44)
SCHEMBL14262421 0.84 GRIN2B (0.46)
SCHEMBL3054791 0.83 NTSR1 (0.40)
SCHEMBL3046330 0.82
SCHEMBL7618677 0.82
SCHEMBL7525973 0.81 MMP2 (0.43)
SCHEMBL7525987 0.81 MMP2 (0.43)

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
US-5166136-A SPIROLACTAM CONTAINING PEPTIDES GLAXO GROUP LIMITED (GB) 1992-11-24 US disclosed