SCHEMBL19956504

SCHEMBL19956504

CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)C(NC(=O)[C@H](CC(C)C)NC(=O)CC(C)C)C(C)C)C(=O)NC(C(=O)OCc1ccccc1)C(C)C

nearest known ligand 0.73

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CTSD P07339 19/20 0.73
REN P00797 3/20 0.73

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
SCHEMBL15606193 1.00 CTSD (0.73) CTSDREN
SCHEMBL15606249 1.00 CTSD (0.73) CTSDREN
SCHEMBL16997414 0.95 CTSD (0.67) CTSDREN
SCHEMBL18745884 0.95 CTSD (0.67) CTSDREN
SCHEMBL16312218 0.94 CTSD (0.84) CTSDREN
SCHEMBL17764793 0.94 CTSD (0.84) CTSDREN
SCHEMBL17764792 0.94 CTSD (0.84) CTSDREN
SCHEMBL16990489 0.91 CTSD (0.87) CTSDREN
SCHEMBL20495546 0.91 CTSD (0.87) CTSDREN
SCHEMBL16990486 0.91 CTSD (0.87) CTSDREN

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
EP-2877485-B1 HYDROXYSTATIN DERIVATIVES FOR TREATMENT OF ARTHROSIS MERCK PATENT GMBH (DE) 2018-03-14 EP disclosed