SCHEMBL2306568

SCHEMBL2306568

COC(=O)[C@H](CCC(=O)O)NC(=O)OC(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTSK P43235 9/20 0.47
CTSS P25774 6/20 0.47
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
HTT P42858 1/20 0.46
CTSL P07711 1/20 0.43
CTSB P07858 1/20 0.43
KLK5 Q9Y337 1/20 0.43
FOLH1 Q04609 2/20 0.42
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
ITGB3 P05106 1/20 0.41
ITGA2B P08514 1/20 0.41
PPARG P37231 1/20 0.41
PPARA Q07869 1/20 0.41

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
SCHEMBL6409351 1.00 CTSK (0.47) CTSKCTSSCYP1A2CYP2C9CYP2C19
SCHEMBL2398972 1.00 CTSK (0.47) CTSKCTSSCYP1A2CYP2C9CYP2C19
SCHEMBL863894 0.92 CTSK (0.48) CTSKCTSSCYP1A2CYP2C9CYP2C19
SCHEMBL863895 0.92 CTSK (0.48) CTSKCTSSCYP1A2CYP2C9CYP2C19
SCHEMBL3773280 0.92 CTSK (0.48) CTSKCTSSCYP1A2CYP2C9CYP2C19
SCHEMBL10606035 0.90 CTSK (0.47) CTSKCTSSCYP1A2CYP2C9CYP2C19
SCHEMBL9690449 0.90 ACE (0.48) CTSKCTSSKLK5FOLH1PPARG
SCHEMBL5129671 0.88 CTSK (0.47) CTSKCTSSITGB3ITGA2B
SCHEMBL17446712 0.88 CTSL (0.56) CTSKCTSSCTSLCTSBFOLH1
SCHEMBL2301394 0.88 CYP1A2 (0.60) CTSKCTSSCYP1A2CYP2C9CYP2C19

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 171 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114436949-B Tetradentate ligand, metal complex, and preparation methods and applications thereof 上海巽田科技股份有限公司 2023-09-22 CN claimed
CN-122094956-A 3CL protease inhibitors and methods thereof 2026-05-26 CN disclosed
US-20260139257-A1 PLIN1 RNAi INTERFERENCE AGENTS ELI LILLY AND CO (US) 2026-05-21 US disclosed
CN-122036541-A Amino acid-based ionizable lipid compound, and preparation method and application thereof 中国科学院广州生物医药与健康研究院 2026-05-15 CN disclosed
EP-4709731-A1 3CLPRO INHIBITORS AND METHODS THEREOF Agency for Science, Technology and Research (SG) 2026-03-18 EP disclosed
WO-2025235719-A1 DIMERIC SMAC MIMETICS USEFUL IN HIV THERAPY VIIV HEALTHCARE COMPANY (US) 2025-11-13 WO disclosed
EP-4638746-A1 NOVEL RNA THERAPEUTICS AND USES THEREOF Eli Lilly and Company (US) 2025-10-29 EP disclosed
EP-4638745-A1 NOVEL FAS RNAI THERAPEUTICS AND USES THEREOF Eli Lilly and Company (US) 2025-10-29 EP disclosed
WO-2025217299-A1 NOVEL LIPIDS CONTAINING DIKETOPIPERAZINE CORE, LIPID NANOPARTICLE CONTAINING THEREOF, AND METHODS OF USING THEREOF GEORGIA TECH RESEARCH CORPORATION (US) 2025-10-16 WO disclosed
US-12357634-B2 2,6-diamino-3,4-dihydropyrimidin-4-one derivatives and use thereof in therapy THOMAS HELLEDAYS STIFTELSE FÖR MEDICINSK FORSKNING (SE) 2025-07-15 US disclosed
US-20080058311-A1 NOVEL DIARYLALKENE DERIVATIVES AND NOVEL DIARYLALKANE DERIVATIVES AJINOMOTO CO., INC. (JP) 2008-03-06 US disclosed
US-7045532-B2 ACE-2 modulating compounds and methods of use thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2006-05-16 US disclosed
US-20050143391-A1 Heterocyclic amides with alpha-4 integrin antagonist activity J. Uriach Y Compañia S.A. (ES) 2005-06-30 US disclosed
US-20050009814-A1 Pharmaceutical composition containing gabapentin or pregabalin and N-type calcium channel antagonist AJINOMOTO CO., INC. (JP) 2005-01-13 US disclosed
EP-1481673-A1 MEDICINAL COMPOSITIONS CONTAINING GABAPENTIN OR PREGABALIN AND N-TYPE CALCIUM CHANNEL ANTAGONIST Ajinomoto Co., Inc. (JP) 2004-12-01 EP disclosed
US-20040167118-A1 Novel diarylalkene derivatives and novel diarylalkane derivatives AJINOMOTO CO., INC. (JP) 2004-08-26 US disclosed
US-20040082496-A1 ACE-2 modulating compounds and methods of use thereof MILLENNIUM PHARMACEUTICALS, INC. 2004-04-29 US disclosed
US-6458948-B1 MIXING A QUATERNARY AMMONIUM SALT HAVING A PARTICULAR TRIAZINE RING IN THE MOLECULES THEREOF, A CARBOXYLIC ACID COMPOUND AND A COMPOUND HAVING A NUCLEOPHILIC FUNCTIONAL GROUP, TO CONDENSE THE CARBOXYLIC ACID WITH THE COMPOUND HAVING THE NUCLEOPHILIC TOKUYAMA CORPORATION (JP) 2002-10-01 US disclosed
US-5552427-A ANTITUMOR AGENTS AND ANTICARCINOGENIC AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-09-03 US disclosed
EP-0656210-A1 Imidazole derivatives as glutaminose inhibitors Takeda Chemical Industries, Ltd. (JP) 1995-06-07 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 (7 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-20040082496-A1 ACE-2 modulating compounds and methods of use thereof ACE, ACE2, AGTR2 CTSK 541/4885CTSS 751/4885CYP1A2 827/4885
US-20050009814-A1 Pharmaceutical composition containing gabapentin or pregabalin and N-type calcium channel antagonist CACNA1B, CACNA1G, CACNA1C CTSK 3359/4885CTSS 3203/4885CYP1A2 1577/4885
US-12357634-B2 2,6-diamino-3,4-dihydropyrimidin-4-one derivatives and use thereof in therapy IL2, THPO, IL6 CTSK 4347/4885CTSS 4585/4885CYP1A2 2815/4885
US-20040167118-A1 Novel diarylalkene derivatives and novel diarylalkane derivatives CACNA1E, CACNA1H, CACNA1D CTSK 1472/4885CTSS 2672/4885CYP1A2 1285/4885
US-20260139257-A1 PLIN1 RNAi INTERFERENCE AGENTS PLIN1, PLIN3, PLIN5 CTSK 3995/4885CTSS 3842/4885CYP1A2 4508/4885
US-20080058311-A1 NOVEL DIARYLALKENE DERIVATIVES AND NOVEL DIARYLALKANE DERIVATIVES CACNA1E, CACNA1D, CACNA1H CTSK 1551/4885CTSS 3169/4885CYP1A2 1223/4885
US-20050143391-A1 Heterocyclic amides with alpha-4 integrin antagonist activity ITGB4, ITGA4, ITGA1 CTSK 2385/4885CTSS 2095/4885CYP1A2 1689/4885

“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.