SCHEMBL647264

SCHEMBL647264

C[C@@H](C(=O)O)N(C(=O)OC(C)(C)C)C1CCCCC1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.37
BTK Q06187 1/20 0.35
GAA P10253 1/20 0.34
EPHX1 P07099 2/20 0.33
CTSS P25774 1/20 0.33
CTSK P43235 1/20 0.33
MAPT P10636 1/20 0.33
ADH1B P00325 1/20 0.33
ADH1C P00326 1/20 0.33
ADH1A P07327 1/20 0.33
KMT2A Q03164 1/20 0.32

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
SCHEMBL9744375 1.00 TSHR (0.37) TSHRBTKGAAEPHX1CTSS
SCHEMBL4328796 1.00 TSHR (0.37) TSHRBTKGAAEPHX1CTSS
SCHEMBL9744380 1.00 TSHR (0.37) TSHRBTKGAAEPHX1CTSS
SCHEMBL2712968 1.00 TSHR (0.37) TSHRBTKGAAEPHX1CTSS
Hydrochloric Acid SCHEMBL30546580 0.98 TSHR (0.36) TSHRBTKGAAEPHX1CTSS
SCHEMBL5131640 0.98 BTK (0.36) TSHRBTKGAAKMT2A
SCHEMBL4996407 0.98 BTK (0.36) TSHRBTKGAAKMT2A
SCHEMBL3672475 0.97 BTK (0.36) TSHRBTKKMT2A
SCHEMBL2350718 0.92 KMT2A (0.34) BTKGAAKMT2A
SCHEMBL2350728 0.92 KMT2A (0.34) BTKGAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118845947-B Preparation process of dendrobium candidum composite particles for clearing liver and improving eyesight 江西省中医药研究院 2025-05-13 CN claimed
CN-118845947-A Preparation process of dendrobium candidum composite particles for clearing liver and improving eyesight 江西省中医药研究院 2024-10-29 CN claimed
CN-104910039-A Functional phenylacetylene compound and preparation method thereof UNIV HARBIN ENG 2015-09-16 CN claimed
US-20070249526-A1 PROCESS FOR THE PREPARATION OF CYCLIC PEPTIDES ABBENANTE GIOVANNI 2007-10-25 US claimed
US-20050119167-A1 Process for the preparation of cyclic peptides THE UNIVERSITY OF QUEENSLAND (AU) 2005-06-02 US claimed
US-12636275-B2 Pharmaceutical use of ketoamide-based compound SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2026-05-26 US disclosed
CN-118845947-B Preparation process of dendrobium candidum composite particles for clearing liver and improving eyesight 江西省中医药研究院 2025-05-13 CN disclosed
WO-2025032242-A1 COMPOUNDS AND USES UNIVERSITEIT LEIDEN (NL) 2025-02-13 WO disclosed
US-12152017-B2 Ketoamide compound and preparation method, pharmaceutical composition, and use thereof SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2024-11-26 US disclosed
CN-118845947-A Preparation process of dendrobium candidum composite particles for clearing liver and improving eyesight 江西省中医药研究院 2024-10-29 CN disclosed
US-11932628-B2 Selective small molecule peptidomimetic melanocortin ligands REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2024-03-19 US disclosed
CN-114933626-B Ginsenoside Rb 1 Derivatives and uses thereof 云南大学 2024-02-09 CN disclosed
US-4485099-A HYPOTENSIVE AGENTS/,ANTIALDOSTERONES MERCK & CO., INC. (US) 1984-11-27 US disclosed
US-4479941-A TREATMENT OF HYPERTENSION AND HYPERALDOSTERONISM MERCK & CO., INC. (US) 1984-10-30 US disclosed
US-4477441-A HYPOTENSIVE AGENTS MERCK & CO., INC. (US) 1984-10-16 US disclosed
US-4477440-A HYPERTENSIVE AGENTS; HYPERALDOSTERONISM; MEDICAL DIAGNOSIS; CYCLIC POLYPEPTIDES MERCK & CO., INC. (US) 1984-10-16 US disclosed
EP-0114993-A2 Renin inhibitory tripeptides MERCK & CO. INC. (US) 1984-08-08 EP disclosed
EP-0081783-A1 Renin inhibitory peptides having Phe 13 deletion MERCK & CO. INC. (US) 1983-06-22 EP disclosed
US-4199501-A INHIBITORS OF SECRETION OF GROWTH HORMONE ELI LILLY AND COMPANY (US) 1980-04-22 US disclosed
US-4061607-A Somatostatin analogs and intermediates thereto ELI LILLY AND COMPANY (US) 1977-12-06 US 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 (5 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-11932628-B2 Selective small molecule peptidomimetic melanocortin ligands MC1R, MC3R, MC4R TSHR 96/4885BTK 844/4885GAA 4676/4885
US-20050119167-A1 Process for the preparation of cyclic peptides C3AR1, C5AR1, C9 TSHR 2661/4885BTK 3731/4885GAA 4826/4885
US-20070249526-A1 PROCESS FOR THE PREPARATION OF CYCLIC PEPTIDES C3AR1, C5AR1, C9 TSHR 2661/4885BTK 3731/4885GAA 4826/4885
US-12636275-B2 Pharmaceutical use of ketoamide-based compound CTSV, CTSL, CTSS TSHR 2450/4885BTK 3136/4885GAA 427/4885
US-12152017-B2 Ketoamide compound and preparation method, pharmaceutical composition, and use thereof ACE, REN, ACE2 TSHR 3993/4885BTK 3470/4885GAA 500/4885

“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.