SCHEMBL20341821

SCHEMBL20341821

C/N=C/C1(NC(=O)C2(NC(=O)c3cc4ccc(-c5ccc(-c6ccno6)cc5)cc4o3)CCC(F)(F)CC2)CC1

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 1/20 0.40
▸ CTSB P07858 1/20 0.40
▸ CTSS P25774 1/20 0.40
▸ BDKRB1 P46663 3/20 0.32
▸ NAMPT P43490 2/20 0.32

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
SCHEMBL23810241 1.00 CTSL (0.40) CTSLCTSBCTSSBDKRB1NAMPT
SCHEMBL18616494 0.87 CTSL (0.43) CTSLCTSBCTSSBDKRB1NAMPT
SCHEMBL18616007 0.83 CTSL (0.45) CTSLCTSBCTSSBDKRB1NAMPT
SCHEMBL18616640 0.82 ACACB (0.31) CTSLCTSBCTSS
SCHEMBL20341777 0.74 TACR2 (0.32) —
SCHEMBL20341822 0.74 CTSS (0.32) CTSS
SCHEMBL23810242 0.74 NAMPT (0.40) NAMPT
SCHEMBL20341848 0.72 CTSS (0.31) CTSS
SCHEMBL23810314 0.72 TP53 (0.33) —
SCHEMBL20341768 0.71 ERN1 (0.39) NAMPT

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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