SCHEMBL19281154

SCHEMBL19281154

CCc1cccc(CC)c1NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)C(NC(=O)CCCc1ccccc1)C(C)C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CTSD P07339 20/20 1.00

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
SCHEMBL17770727 1.00 CTSD (1.00) CTSD
SCHEMBL12475159 0.86 CTSD (0.76) CTSD
SCHEMBL12475157 0.86 CTSD (0.76) CTSD
SCHEMBL19696448 0.81 CTSD (1.00) CTSD
SCHEMBL12475071 0.81 CTSD (1.00) CTSD
SCHEMBL17758210 0.77 CTSD (0.77) CTSD
SCHEMBL17758206 0.77 CTSD (0.77) CTSD
SCHEMBL17758209 0.77 CTSD (0.77) CTSD
SCHEMBL19696447 0.77 CTSD (0.91) CTSD
SCHEMBL17770717 0.75 CTSD (0.84) CTSD

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
EP-2673287-B1 AMINO STATIN DERIVATIVES FOR THE TREATMENT OF ARTHROSIS MERCK PATENT GMBH (DE) 2017-08-30 EP claimed
US-9839665-B2 Aminostatin derivatives for the treatment of arthrosis MERCK PATENT GMBH (DE) 2017-12-12 US disclosed