SCHEMBL23810251

SCHEMBL23810251

C[S+]([O-])c1ccc(-c2ccc3cc(C(=O)NC4(C(=O)NC5(C#N)CC5)CCCCC4)oc3n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 15/20 0.43
▸ CTSS P25774 18/20 0.35
▸ CTSB P07858 17/20 0.35
▸ CTSK P43235 5/20 0.35

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
SCHEMBL18616543 0.88 CTSL (0.43) CTSLCTSSCTSBCTSK
SCHEMBL20341765 0.87 CTSL (0.44) CTSLCTSSCTSBCTSK
SCHEMBL23810246 0.85 CTSL (0.45) CTSLCTSSCTSBCTSK
SCHEMBL23810255 0.85 CTSL (0.45) CTSLCTSSCTSBCTSK
SCHEMBL18616529 0.84 CTSL (0.43) CTSLCTSSCTSBCTSK
SCHEMBL20341781 0.79 CTSL (0.40) CTSLCTSSCTSBCTSK
SCHEMBL23810283 0.77 CTSL (0.38) CTSLCTSSCTSBCTSK
SCHEMBL18615940 0.73 CTSL (0.45) CTSLCTSSCTSBCTSK
SCHEMBL18616546 0.73 CTSL (0.45) CTSLCTSSCTSBCTSK
SCHEMBL18616651 0.73 CTSL (0.45) CTSLCTSSCTSBCTSK

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
EP-3342765-B1 CATHEPSIN K INHIBITOR AND APPLICATION THEREOF SUNSHINE LAKE PHARMA CO LTD (CN) 2021-09-15 — — EP disclosed
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