SCHEMBL18616610

SCHEMBL18616610

N#CC1(NC(=O)C2(NC(=O)c3cc4ccc(-c5ccc(C6(OC(F)F)COC6)cc5)cc4o3)CCCCC2)CC1

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 7/20 0.40
▸ CTSS P25774 10/20 0.36
▸ CTSK P43235 4/20 0.36
▸ CTSB P07858 7/20 0.34
▸ TACR2 P21452 2/20 0.34

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
SCHEMBL18617460 0.92 CTSL (0.35) CTSLCTSSCTSKCTSB
SCHEMBL18615882 0.90 CTSL (0.42) CTSLCTSSCTSKCTSBTACR2
SCHEMBL18615885 0.87 CTSL (0.44) CTSLCTSSCTSKCTSBTACR2
SCHEMBL18616834 0.86 CTSL (0.45) CTSLCTSSCTSKCTSBTACR2
SCHEMBL18616609 0.86 CTSL (0.45) CTSLCTSSCTSKCTSBTACR2
SCHEMBL18615883 0.86 CTSL (0.45) CTSLCTSSCTSKCTSBTACR2
SCHEMBL18615930 0.83 CTSL (0.46) CTSLCTSSCTSKCTSBTACR2
SCHEMBL23810318 0.83 CTSL (0.41) CTSLCTSSCTSKCTSBTACR2
SCHEMBL23810312 0.83 CTSL (0.49) CTSLCTSSCTSKCTSBTACR2
SCHEMBL18615884 0.82 CTSL (0.44) CTSLCTSSCTSKCTSBTACR2

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 3 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-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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