SCHEMBL18615896

SCHEMBL18615896

N#CC1(NC(=O)C2(NC(=O)c3cc4ccc(-c5ccc(C6(O)CC[S+]([O-])CC6)cc5)cc4o3)CCC(F)(F)CC2)CC1

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 1/20 0.35
▸ CTSK P43235 2/20 0.33
▸ CTSS P25774 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
SCHEMBL18615966 0.93 CTSL (0.36) CTSLCTSKCTSS
SCHEMBL23810234 0.92 CTSL (0.42) CTSLCTSKCTSS
SCHEMBL20335394 0.90 CTSL (0.37) CTSLCTSKCTSS
SCHEMBL18616498 0.90 CTSL (0.38) CTSLCTSKCTSS
SCHEMBL20335410 0.89 CTSL (0.36) CTSLCTSKCTSS
SCHEMBL18615963 0.89 CTSL (0.36) CTSLCTSKCTSS
SCHEMBL18616686 0.89 CTSL (0.38) CTSLCTSKCTSS
SCHEMBL20335436 0.88 CTSL (0.38) CTSLCTSKCTSS
SCHEMBL20341825 0.88 CTSL (0.37) CTSLCTSKCTSS
SCHEMBL20341826 0.87 CTSL (0.35) CTSL

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 2 patents. 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
WO-2017036357-A1 CATHEPSIN K INHIBITOR AND APPLICATION THEREOF 广东东阳光药业有限公司 2017-03-09 — — WO disclosed
Send feedback