SCHEMBL10707184

SCHEMBL10707184

CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](C(=O)O)C(C)C

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 2/20 0.63
▸ CTSS P25774 2/20 0.63
▸ CTSK P43235 2/20 0.63
▸ CTSB P07858 1/20 0.63
▸ FNTA P49354 1/20 0.53
▸ FNTB P49356 1/20 0.53
▸ CAPN1 P07384 1/20 0.52
▸ PSEN1 P49768 4/20 0.48
▸ PSEN2 P49810 4/20 0.48
▸ APH1B Q8WW43 4/20 0.48
▸ NCSTN Q92542 4/20 0.48
▸ APH1A Q96BI3 4/20 0.48
▸ PSENEN Q9NZ42 4/20 0.48
▸ CA1 P00915 1/20 0.48
▸ CA2 P00918 1/20 0.48
▸ CA7 P43166 1/20 0.48
▸ REN P00797 3/20 0.47
▸ GAA P10253 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ AAK1 Q2M2I8 1/20 0.47

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
SCHEMBL11795309 0.87 CTSL (0.58) CTSLCTSSCTSKCTSBFNTA
SCHEMBL29918220 0.87 CTSS (0.53) CTSLCTSSCTSKCTSBFNTA
SCHEMBL25977614 0.87 CTSL (0.68) CTSLCTSSCTSKCTSBFNTA
SCHEMBL27350811 0.87 CTSL (0.68) CTSLCTSSCTSKCTSBFNTA
SCHEMBL7392267 0.87 CTSL (0.68) CTSLCTSSCTSKCTSBFNTA
SCHEMBL4576781 0.87 CTSL (0.68) CTSLCTSSCTSKCTSBFNTA
SCHEMBL17770756 0.86 CTSS (0.63) CTSLCTSSCTSKCTSBFNTA
SCHEMBL29308942 0.85 CTSS (0.66) CTSLCTSSCTSKCTSBFNTA
SCHEMBL9336693 0.85 CTSS (0.66) CTSLCTSSCTSKCTSBFNTA
SCHEMBL9338814 0.85 CTSS (0.66) CTSLCTSSCTSKCTSBFNTA

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114315963-B LSH series cyclic pentapeptide ester and synthetic method and application thereof 河北科技大学 2023-11-17 — — CN disclosed
CN-114315963-A LSH series cyclic pentapeptide ester and synthetic method and application thereof 河北科技大学 2022-04-12 — — CN disclosed
WO-2021236475-A1 COMPOUNDS THAT INHIBIT ASPARAGINE SYNTHETASE AND THEIR METHODS OF USE ASINEX CORPORATION (US) 2021-11-25 — — WO disclosed
WO-2021027744-A1 3-HYDROXY-5-PREGNANE-20-ONE DERIVATIVE AND USE THEREOF 南京诺瑞特医药科技有限公司 2021-02-18 — — WO disclosed
US-9839665-B2 Aminostatin derivatives for the treatment of arthrosis MERCK PATENT GMBH (DE) 2017-12-12 — — US disclosed
US-9839665-B2 Aminostatin derivatives for the treatment of arthrosis MERCK PATENT GMBH (DE) 2017-12-12 — — US disclosed
EP-2673287-B1 AMINO STATIN DERIVATIVES FOR THE TREATMENT OF ARTHROSIS MERCK PATENT GMBH (DE) 2017-08-30 — — EP disclosed
US-20160228493-A1 AMINOSTATIN DERIVATIVES FOR THE TREATMENT OF ARTHROSIS MERCK PATENT GMBH (DE) 2016-08-11 — — US disclosed
US-20160228493-A1 AMINOSTATIN DERIVATIVES FOR THE TREATMENT OF ARTHROSIS MERCK PATENT GMBH (DE) 2016-08-11 — — US disclosed
US-9345742-B2 Aminostatin derivatives for the treatment of arthrosis MERCK PATENT GMBH (DE) 2016-05-24 — — US disclosed
US-9345742-B2 Aminostatin derivatives for the treatment of arthrosis MERCK PATENT GMBH (DE) 2016-05-24 — — US disclosed
EP-0126974-B1 CARBOXYALKYL PEPTIDE DERIVATIVES G.D. Searle & Co. (US) 1988-06-15 — — EP disclosed
US-4568666-A COLLAGENASE INHIBITORS, ANTIARTJRITIC AGENTS G. D. SEARLE & CO. (US) 1986-02-04 — — US disclosed
EP-0126974-A1 Carboxyalkyl peptide derivatives G.D. Searle & Co. (US) 1984-12-05 — — EP 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-20160228493-A1 AMINOSTATIN DERIVATIVES FOR THE TREATMENT OF ARTHROSIS CTSD, CTSB, CTSZ CTSL 4/4885CTSS 8/4885CTSK 5/4885

“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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