SCHEMBL9911976

SCHEMBL9911976

CCC(C)(CC(=O)NN)CC(C)CC(N)=O

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CTSD P07339 1/20 0.32

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
SCHEMBL26893756 0.71 CTSD (0.40) CTSD
SCHEMBL4183750 0.69 ECE1 (0.32)
SCHEMBL17304512 0.69 CTSD (0.39) CTSD
SCHEMBL29489578 0.66 KDM4E (0.31)
SCHEMBL23288379 0.66 ALDH1A1 (0.33)
SCHEMBL12335996 0.66 CTSD (0.46) CTSD
SCHEMBL12308797 0.65 CTSD (0.37) CTSD
SCHEMBL3392036 0.64 ALDH1A1 (0.38)
SCHEMBL27335059 0.64 CTSD (0.35) CTSD
SCHEMBL2827132 0.62

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
WO-2012050645-A9 PATHOGEN DETECTION PURDUE RESEARCH FOUNDATION (US) 2012-06-07 WO disclosed
WO-2012050645-A2 PATHOGEN DETECTION PURDUE RESEARCH FOUNDATION (US) 2012-04-19 WO disclosed