SCHEMBL23723119

SCHEMBL23723119

CC1Cc2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)N[C@H](C=O)C[C@@H]3CCNC3=O)ccc2N1

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CTSL P07711 2/20 0.47
CTSB P07858 2/20 0.47
CTSS P25774 1/20 0.47

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
SCHEMBL23722384 0.81 CTSL (0.57) CTSLCTSBCTSS
SCHEMBL23722386 0.81 CTSL (0.48) CTSLCTSBCTSS
SCHEMBL23722924 0.81 CTSL (0.47) CTSLCTSBCTSS
SCHEMBL25766848 0.80 CTSL (0.56) CTSLCTSB
SCHEMBL30914040 0.80 CTSL (0.54) CTSLCTSB
SCHEMBL23721438 0.78 CTSL (0.46) CTSLCTSBCTSS
SCHEMBL24766500 0.77 PSMB8 (0.49) CTSLCTSBCTSS
SCHEMBL23722339 0.77 PSMB8 (0.49) CTSLCTSBCTSS
SCHEMBL26452800 0.77 CTSL (0.51) CTSL
SCHEMBL23722575 0.76 MEN1 (0.47) CTSLCTSBCTSS

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-2021151265-A1 PHARMACEUTICAL USE OF ALDEHYDE-BASED COMPOUND 中国科学院上海药物研究所 2021-08-05 WO disclosed