SCHEMBL29063295

SCHEMBL29063295

CC(C)(F)CC(NC(=O)OC(C)(C)C)C(=O)NC(CC1CCNC1=O)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 1/20 0.46
▸ CTSL P07711 3/20 0.44
▸ CTSB P07858 2/20 0.44

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
SCHEMBL29062773 0.94 IDO1 (0.45) IDO1CTSLCTSB
SCHEMBL23824575 0.92 IDO1 (0.45) IDO1
SCHEMBL23824578 0.92 IDO1 (0.45) IDO1
SCHEMBL25284030 0.91 CTSL (0.43) CTSLCTSB
SCHEMBL24020503 0.91 CTSL (0.43) CTSLCTSB
SCHEMBL25284029 0.91 CTSL (0.43) CTSLCTSB
SCHEMBL23782048 0.89 IDO1 (0.52) IDO1CTSLCTSB
SCHEMBL8278579 0.89 IDO1 (0.52) IDO1CTSLCTSB
SCHEMBL23782050 0.89 IDO1 (0.52) IDO1CTSLCTSB
SCHEMBL27231152 0.89 IDO1 (0.52) IDO1CTSLCTSB

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
CN-116685576-A Cysteine protease inhibitors and methods of use thereof 美商帕迪斯生物科学公司 2023-09-01 — — CN disclosed
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