SCHEMBL18615903

SCHEMBL18615903

CC1(C)OB(c2ccc3cc(C(=O)NC4(C(=O)NC5(C#N)CC5)CCCCC4)oc3c2)OC1(C)C

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 12/20 0.46
▸ CTSS P25774 12/20 0.40
▸ CTSK P43235 8/20 0.40
▸ CTSB P07858 10/20 0.37
▸ TACR2 P21452 1/20 0.34
▸ CA1 P00915 2/20 0.33
▸ CA2 P00918 2/20 0.33
▸ CA9 Q16790 2/20 0.33

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
SCHEMBL18615954 0.91 CTSL (0.38) CTSLCTSSCTSKCTSBCA1
SCHEMBL20335433 0.82 CTSL (0.52) CTSLCTSSCTSKCTSBTACR2
SCHEMBL20335396 0.82 CTSL (0.52) CTSLCTSSCTSKCTSBTACR2
SCHEMBL28425902 0.82 CTSL (0.63) CTSLCTSSCTSKCTSBCA1
SCHEMBL28421516 0.82 CTSL (0.63) CTSLCTSSCTSKCTSBCA1
SCHEMBL23810312 0.80 CTSL (0.49) CTSLCTSSCTSKCTSBTACR2
SCHEMBL23810246 0.80 CTSL (0.45) CTSLCTSSCTSKCTSBTACR2
SCHEMBL23810255 0.80 CTSL (0.45) CTSLCTSSCTSKCTSBTACR2
SCHEMBL18615930 0.79 CTSL (0.46) CTSLCTSSCTSKCTSBTACR2
SCHEMBL18616651 0.78 CTSL (0.45) CTSLCTSSCTSKCTSB

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 6 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
CN-107922315-B Cathepsin K inhibitors and uses thereof 广东东阳光药业有限公司 2021-03-26 — — CN 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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