SCHEMBL20341807

SCHEMBL20341807

CSc1ccc(-c2ccc3cc(C(=O)NC4(C(=O)NC5(C#N)CC5)CCOCC4)oc3c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 4/20 0.39
▸ TACR2 P21452 2/20 0.34
▸ CTSS P25774 2/20 0.33
▸ CTSK P43235 2/20 0.33
▸ ANO1 Q5XXA6 3/20 0.32
▸ CTSC P53634 2/20 0.32
▸ CTSB P07858 2/20 0.31
▸ MMP1 P03956 1/20 0.31
▸ MMP14 P50281 1/20 0.31
▸ CNR1 P21554 1/20 0.31

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
SCHEMBL20341808 0.93 CTSL (0.47) CTSLTACR2CTSSCTSKCTSB
SCHEMBL20341771 0.90 CTSL (0.38) CTSLCTSSCTSKCTSB
SCHEMBL18616590 0.87 CTSC (0.41) CTSLCTSSCTSKCTSCCTSB
SCHEMBL20341762 0.84 CTSL (0.46) CTSLTACR2CTSSCTSKCTSB
SCHEMBL18615957 0.83 TACR2 (0.37) CTSLTACR2CTSSCTSKCTSB
SCHEMBL18615884 0.83 CTSL (0.44) CTSLTACR2CTSSCTSKCTSB
SCHEMBL20335394 0.81 CTSL (0.37) CTSLTACR2CTSSCTSKANO1
SCHEMBL23810312 0.81 CTSL (0.49) CTSLTACR2CTSSCTSKCTSB
SCHEMBL20341828 0.80 CTSL (0.37) CTSLCTSSCTSKCTSB
SCHEMBL18617379 0.80 NPC1 (0.42) CTSLTACR2CTSSCTSKCTSB

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-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
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