SCHEMBL18616522

SCHEMBL18616522

N#CC1(NC(=O)C2(NC(=O)c3cc4c(F)cc(-c5ccc(C6(O)COC6)cc5)cc4o3)CCCCC2)CC1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 9/20 0.42
▸ CTSS P25774 11/20 0.35
▸ CTSK P43235 9/20 0.35
▸ CTSB P07858 7/20 0.35
▸ MMP13 P45452 1/20 0.32
▸ POLB P06746 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ NPC1 O15118 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
SCHEMBL18615883 0.87 CTSL (0.45) CTSLCTSSCTSKCTSB
SCHEMBL18616609 0.87 CTSL (0.45) CTSLCTSSCTSKCTSB
SCHEMBL18616524 0.85 CTSL (0.43) CTSLCTSSCTSKCTSBPOLB
SCHEMBL18616498 0.81 CTSL (0.38) CTSLCTSSCTSKCTSB
SCHEMBL18615930 0.80 CTSL (0.46) CTSLCTSSCTSKCTSB
SCHEMBL18615884 0.79 CTSL (0.44) CTSLCTSSCTSKCTSB
SCHEMBL18615885 0.79 CTSL (0.44) CTSLCTSSCTSKCTSB
SCHEMBL18616834 0.78 CTSL (0.45) CTSLCTSSCTSKCTSB
SCHEMBL18616529 0.78 CTSL (0.43) CTSLCTSSCTSKCTSB
SCHEMBL18616483 0.78 CTSL (0.44) 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 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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