SCHEMBL18616007

SCHEMBL18616007

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

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 5/20 0.45
▸ CTSS P25774 5/20 0.45
▸ CTSB P07858 3/20 0.45
▸ BDKRB1 P46663 2/20 0.32
▸ LIPG Q9Y5X9 1/20 0.32
▸ CTSK P43235 5/20 0.32
▸ NAMPT P43490 3/20 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
SCHEMBL18616494 0.87 CTSL (0.43) CTSLCTSSCTSBBDKRB1NAMPT
SCHEMBL18616005 0.86 CTSL (0.37) CTSLCTSSLIPGCTSKNAMPT
SCHEMBL20335438 0.85 CTSL (0.38) CTSLCTSSCTSBLIPGCTSK
SCHEMBL20341771 0.85 CTSL (0.38) CTSLCTSSCTSBCTSK
SCHEMBL20341764 0.85 CTSL (0.38) CTSLCTSSCTSBCTSK
SCHEMBL20341786 0.85 CTSL (0.38) CTSLCTSSCTSBCTSK
SCHEMBL18615980 0.85 CTSL (0.36) CTSLCTSSCTSBBDKRB1CTSK
SCHEMBL18615858 0.84 CTSL (0.37) CTSLCTSSLIPGCTSKNAMPT
SCHEMBL20335394 0.84 CTSL (0.37) CTSLCTSSCTSBCTSK
SCHEMBL23810283 0.84 CTSL (0.38) 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 5 patents. 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
EP-3342765-B1 CATHEPSIN K INHIBITOR AND APPLICATION THEREOF SUNSHINE LAKE PHARMA CO LTD (CN) 2021-09-15 — — EP disclosed
EP-3342765-A1 CATHEPSIN K INHIBITOR AND APPLICATION THEREOF Sunshine Lake Pharma Co., Ltd. (CN) 2018-07-04 — — EP disclosed
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
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