SCHEMBL25309469

SCHEMBL25309469

COc1cc(F)cc2c3c([nH]c12)CCN(C(=O)[C@@H]1CCCC[C@H]1C(=O)NC1COCC1=O)C3

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CTSB P07858 5/20 0.47
▸ CTSS P25774 1/20 0.47
▸ CTSK P43235 16/20 0.47
▸ KDM4E B2RXH2 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38

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
SCHEMBL30497446 1.00 CTSB (0.47) CTSBCTSSCTSKKDM4EMEN1
SCHEMBL29076290 0.88 CTSK (0.52) CTSBCTSSCTSK
SCHEMBL30497445 0.88 CTSK (0.52) CTSBCTSSCTSK
SCHEMBL29076287 0.88 CTSK (0.52) CTSBCTSSCTSK
SCHEMBL29076337 0.84 CTSB (0.41) CTSBCTSSCTSK
SCHEMBL29076335 0.84 CTSB (0.41) CTSBCTSSCTSK
SCHEMBL30497450 0.84 CTSB (0.41) CTSBCTSSCTSK
SCHEMBL30497451 0.84 CTSB (0.41) CTSBCTSSCTSK
SCHEMBL30497449 0.82 CTSK (0.51) CTSBCTSSCTSK
SCHEMBL29076137 0.81 CTSK (0.65) CTSBCTSSCTSK

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
US-20250145576-A1 CATHEPSIN K INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF SHANDONG NEW TIME PHARMACEUTICAL CO., LTD. (CN) 2025-05-08 — — US claimed
EP-4467544-A1 CATHEPSIN K INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF Shandong New Time Pharmaceutical Co., Ltd. (CN) 2024-11-27 — — EP claimed
WO-2023138695-A1 CATHEPSIN K INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF 山东新时代药业有限公司 2023-07-27 — — WO claimed
US-20250145576-A1 CATHEPSIN K INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF SHANDONG NEW TIME PHARMACEUTICAL CO., LTD. (CN) 2025-05-08 — — US disclosed
EP-4467544-A1 CATHEPSIN K INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF Shandong New Time Pharmaceutical Co., Ltd. (CN) 2024-11-27 — — EP disclosed
WO-2023138695-A1 CATHEPSIN K INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF 山东新时代药业有限公司 2023-07-27 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20250145576-A1 CATHEPSIN K INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF CTSF, CTSK, CTSZ CTSB 9/4885CTSS 4/4885CTSK 2/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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