SCHEMBL19924892

SCHEMBL19924892

CC(C)C[C@H](NC(=O)[C@H](CN1CCC(F)CC1)NC(=O)O)C(=O)N[C@@H](C[C@@H]1CCNC1=O)C(=O)C(=O)NC(C)C

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 1/20 0.46
▸ CTSB P07858 1/20 0.46

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
SCHEMBL19924894 1.00 CTSL (0.46) CTSLCTSB
SCHEMBL19924829 0.93 CTSL (0.47) CTSLCTSB
SCHEMBL19924827 0.93 CTSL (0.47) CTSLCTSB
SCHEMBL19924781 0.92 CTSL (0.46) CTSLCTSB
SCHEMBL19924780 0.92 CTSL (0.46) CTSLCTSB
SCHEMBL19924788 0.92 CTSL (0.46) CTSLCTSB
SCHEMBL19924778 0.92 CTSL (0.46) CTSLCTSB
SCHEMBL19924777 0.92 CTSL (0.46) CTSLCTSB
SCHEMBL19924846 0.89 CTSL (0.53) CTSLCTSB
SCHEMBL19924845 0.89 CTSL (0.53) CTSLCTSB

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
WO-2018042343-A2 COMPOUNDS THAT INHIBIT 3C AND 3CL PROTEASES AND METHODS OF USE THEREOF GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2018-03-08 — — WO disclosed
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