SCHEMBL20341776

SCHEMBL20341776

C#CC1(NC(=O)C2(NC(=O)c3cc4ccc(-c5ccc(OC6COC6)cc5)cc4o3)CCC(F)(F)CC2)CC1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 1/20 0.32
▸ CTSL P07711 2/20 0.31
▸ CTSB P07858 2/20 0.31
▸ CTSS P25774 2/20 0.31
▸ CACNA1G O43497 1/20 0.30
▸ CACNA1H O95180 1/20 0.30
▸ CACNA1I Q9P0X4 1/20 0.30

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
SCHEMBL18615855 0.92 CTSL (0.36) ACACBCTSLCTSBCTSSCACNA1G
SCHEMBL20341849 0.92 CTSL (0.38) ACACBCTSLCTSBCTSS
SCHEMBL23810245 0.84 ACACB (0.33) ACACBCTSLCTSBCTSS
SCHEMBL18616640 0.84 ACACB (0.31) ACACBCTSLCTSBCTSS
SCHEMBL23810282 0.83 CTSL (0.42) ACACBCTSLCTSBCTSSCACNA1H
SCHEMBL18616019 0.83 ACACB (0.38) ACACBCACNA1GCACNA1HCACNA1I
SCHEMBL18616645 0.82 CTSS (0.39) CTSLCTSBCTSSCACNA1H
SCHEMBL20335400 0.82 CTSL (0.39) CTSLCTSBCTSSCACNA1H
SCHEMBL23810291 0.80 — —
SCHEMBL20341846 0.80 CTSL (0.37) CTSLCTSBCTSSCACNA1H

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-A1 CATHEPSIN K INHIBITOR AND APPLICATION THEREOF Sunshine Lake Pharma Co., Ltd. (CN) 2018-07-04 — — EP disclosed
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