SCHEMBL2398972

SCHEMBL2398972

COC(=O)C(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
SCHEMBL2306568 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 98 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260139257-A1 PLIN1 RNAi INTERFERENCE AGENTS ELI LILLY AND CO (US) 2026-05-21 US disclosed
US-20250382615-A1 NOVEL RNA THERAPEUTICS AND USES THEREOF LILLY CO ELI (US) 2025-12-18 US disclosed
US-12459922-B2 PARP7 inhibitors GILEAD SCIENCES, INC. (US) 2025-11-04 US disclosed
EP-4638747-A1 NOVEL RNA THERAPEUTICS AND USES THEREOF Eli Lilly and Company (US) 2025-10-29 EP disclosed
EP-4638746-A1 NOVEL RNA THERAPEUTICS AND USES THEREOF Eli Lilly and Company (US) 2025-10-29 EP 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-20250127913-A1 BIFUNCTIONAL FOLATE RECEPTOR BINDING COMPOUNDS LYCIA THERAPEUTICS, INC. 2025-04-24 US disclosed
EP-4469448-A1 PARP7 INHIBITORS GILEAD SCIENCES, INC. (US) 2024-12-04 EP disclosed
US-20240327839-A1 NOVEL THERAPEUTIC DELIVERY MOIETIES AND USES THEREOF LILLY CO ELI (US) 2024-10-03 US disclosed
US-12037354-B2 Cyclic pantetheine derivatives and uses thereof VECTIVBIO COMET AG (CH) 2024-07-16 US disclosed
CN-1196686-C Method for storing quaternary ammonium salt TOKUYAMA CORP (JP) 2005-04-13 CN 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
CN-1372554-A Method for preserving quaternary ammonium salts TOKUYAMA CORP (JP) 2002-10-02 CN disclosed
WO-2002039997-A2 ACE-2 MODULATING COMPOUNDS AND USE THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2002-05-23 WO disclosed
CN-1304392-A Process for producing carboxylic acid derivative and condensing agent comprising quaternary ammonium salt TOKUYAMA CORP (JP) 2001-07-18 CN disclosed
CN-1169986-A 2.9-diamino-and 2-amino-8-carbamoyl-4-hydroxy-aldanoic acid amide derivatives CIBA GEIGY AG (CH) 1998-01-14 CN disclosed
EP-0050799-B1 NEW PROCESSES FOR THE PRODUCTION OF DI-ALKYL ESTERS AND OPTICALLY ACTIVE MONO-ALKYL ESTERS OF 3-AMINOGLUTARIC ACID ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1984-12-19 EP disclosed
EP-0050799-A1 New processes for the production of di-alkyl esters and optically active mono-alkyl esters of 3-aminoglutaric acid ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1982-05-05 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 (9 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-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-20250382615-A1 NOVEL RNA THERAPEUTICS AND USES THEREOF LDLR, TEK, PCSK9 CTSK 1590/4885CTSS 2552/4885CYP1A2 4809/4885
US-20250127913-A1 BIFUNCTIONAL FOLATE RECEPTOR BINDING COMPOUNDS FOLR1, FOLR2, FOLH1 CTSK 936/4885CTSS 446/4885CYP1A2 4628/4885
US-20260139257-A1 PLIN1 RNAi INTERFERENCE AGENTS PLIN1, PLIN3, PLIN5 CTSK 3995/4885CTSS 3842/4885CYP1A2 4508/4885
US-12459922-B2 PARP7 inhibitors PARP1, PARP11, PARP2 CTSK 2511/4885CTSS 3101/4885CYP1A2 2422/4885
US-12037354-B2 Cyclic pantetheine derivatives and uses thereof VNN1, VKORC1, PANK3 CTSK 2167/4885CTSS 2726/4885CYP1A2 503/4885
US-20240327839-A1 NOVEL THERAPEUTIC DELIVERY MOIETIES AND USES THEREOF FABP1, HAVCR2, SLC10A1 CTSK 2644/4885CTSS 2301/4885CYP1A2 4812/4885

“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.