SCHEMBL198310

SCHEMBL198310

CC1=C(C)C(C)(C)C([Ru])=C1C

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CTSD P07339 1/20 0.35

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
Hydrochloric Acid SCHEMBL1450192 0.97 CTSD (0.33) CTSD
Hydrochloric Acid SCHEMBL14954076 0.97 CTSD (0.33) CTSD
Iodide SCHEMBL14954347 0.97 CTSD (0.33) CTSD
Water SCHEMBL6129328 0.97 CTSD (0.33) CTSD
Fluoride SCHEMBL14954494 0.97 CTSD (0.33) CTSD
Bromide SCHEMBL14953771 0.97 CTSD (0.33) CTSD
SCHEMBL14954367 0.97 CTSD (0.33) CTSD
SCHEMBL18605788 0.77 CYP3A4 (0.44)
SCHEMBL2230540 0.75 CTSD (0.43) CTSD
SCHEMBL28961651 0.67 CTSD (0.38) CTSD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118108753-A N, N-dialkyl thioformyl-containing 2-silicon-based indole or pyrrole compound and synthesis method and application thereof 杭州师范大学 2024-05-31 CN claimed
CN-117886752-A Preparation method of benzo-octamembered cyclic amide compound 五邑大学 2024-04-16 CN claimed
CN-117561259-A Preparation method of nitrogen-containing polycyclic condensed ring compound, intermediate and application thereof 北京志健金瑞生物医药科技有限公司 2024-02-13 CN claimed
CN-113620875-B 3-nitrile quinoline derivative and preparation method thereof 郑州大学 2023-06-23 CN claimed
CN-114736230-A Preparation method of 2-silicon-based indole compound 杭州师范大学 2022-07-12 CN claimed
CN-112110845-B Synthesis method of bazedoxifene and analogues thereof 中国科学院福建物质结构研究所 2022-06-10 CN claimed
CN-111978151-B Preparation method of 3-methyl-2-butenol 山东新和成药业有限公司 2022-05-17 CN claimed
CN-113620875-A 3-cyano quinoline derivative and preparation method thereof 郑州大学 2021-11-09 CN claimed
CN-112876507-A Trisubstituted olefin tertiary phosphine compound and preparation method thereof 湖北大学 2021-06-01 CN claimed
CN-112110845-A Synthesis method of bazedoxifene and analogues thereof 中国科学院福建物质结构研究所 2020-12-22 CN claimed
CN-111978151-A Preparation method of 3-methyl-2-butenol 山东新和成药业有限公司 2020-11-24 CN claimed
CN-108226473-B Application of transition metal catalytic oxidation reduction fluorescence regulation and control system in detection of biological protein marker 中国科学院青岛生物能源与过程研究所 2020-09-11 CN claimed
US-8372986-B2 Ruthenium-catalyzed cycloaddition of alkynes and organic azides THE SCRIPPS RESEARCH INSTITUTE (US) 2013-02-12 US claimed
US-20100286405-A1 Ruthenium-Catalyzed Cycloaddition of Alkynes and Organic Azides NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-11-11 US claimed
EP-4392079-A1 PURIFIED SIGNAL-ENHANCED CONTRAST AGENTS FOR MAGNETIC RESONANCE IMAGING Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2024-07-03 EP disclosed
CN-118108753-A N, N-dialkyl thioformyl-containing 2-silicon-based indole or pyrrole compound and synthesis method and application thereof 杭州师范大学 2024-05-31 CN disclosed
CN-117980303-A Novel compounds and their use in the treatment of bacterial infections 豪夫迈·罗氏有限公司 2024-05-03 CN disclosed
US-20070083053-A1 Process for producing indole compound NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2007-04-12 US disclosed
CN-1102161-C Photocurable composition THREE BOND CO LTD (JP) 2003-02-26 CN disclosed
CN-1153794-A Photocurable composition THREE BOND CO LTD (JP) 1997-07-09 CN 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 (2 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-20100286405-A1 Ruthenium-Catalyzed Cycloaddition of Alkynes and Organic Azides CBR3, AOC3, CYB5R3 CTSD 2800/4885
US-20070083053-A1 Process for producing indole compound IDO2, IDO1, TDO2 CTSD 2830/4885

“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.