SCHEMBL30001969

SCHEMBL30001969

CC(C)(C)OC(=O)N[C@@H](CC1CCCCC1)C(=O)NC(CC1CCNC1=O)C(N)=O

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CTSS P25774 2/20 0.53
▸ CTSK P43235 2/20 0.53
▸ CTSL P07711 3/20 0.51
▸ CTSB P07858 2/20 0.51
▸ AAK1 Q2M2I8 1/20 0.45

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
SCHEMBL24691130 1.00 CTSS (0.53) CTSSCTSKCTSLCTSBAAK1
SCHEMBL24691128 0.94 CTSS (0.46) CTSSCTSKCTSLCTSBAAK1
SCHEMBL30001761 0.94 CTSS (0.46) CTSSCTSKCTSLCTSBAAK1
SCHEMBL23824306 0.91 CTSS (0.48) CTSSCTSKCTSLCTSBAAK1
SCHEMBL23824331 0.91 CTSS (0.56) CTSSCTSKCTSLCTSB
SCHEMBL23824309 0.91 CTSS (0.48) CTSSCTSKCTSLCTSBAAK1
SCHEMBL23824334 0.91 CTSS (0.56) CTSSCTSKCTSLCTSB
SCHEMBL23824328 0.91 CTSS (0.56) CTSSCTSKCTSLCTSB
SCHEMBL23824669 0.91 CTSS (0.56) CTSSCTSKCTSLCTSB
SCHEMBL23824614 0.90 CTSL (0.53) CTSSCTSKCTSLCTSBAAK1

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-4347034-A1 PROTEASE INHIBITORS AS ANTIVIRALS ACEA Therapeutics, Inc. (US) 2024-04-10 — — EP disclosed
WO-2022256434-A1 PROTEASE INHIBITORS AS ANTIVIRALS ACEA Therapeutics, Inc. (US) 2022-12-08 — — WO disclosed
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