⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Benzene SCHEMBL9443045 | 1.00 | TSHR (0.75) | — | |
| Benzene SCHEMBL5471371 | 1.00 | — | — | |
| Benzene SCHEMBL30503981 | 1.00 | TSHR (0.75) | — | |
| SCHEMBL1086976 | 0.87 | TSHR (1.00) | — | |
| Benzene SCHEMBL8430159 | 0.87 | TSHR (1.00) | — | |
| SCHEMBL1112772 | 0.87 | TSHR (1.00) | — | |
| Benzene SCHEMBL8576855 | 0.87 | TSHR (1.00) | — | |
| Benzene SCHEMBL10780001 | 0.87 | TSHR (1.00) | — | |
| Benzene SCHEMBL1330958 | 0.87 | — | — | |
| Benzene SCHEMBL8107103 | 0.87 | TSHR (1.00) | — |
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 726 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20250000948-A1 | SOLID COMPOSITIONS COMPRISING A PEPTIDE OR A PROTEIN AND AN ACYLATED AMINO ACID | ADOCIA (FR) | 2025-01-02 | — | — | US | claimed |
| CN-220352024-U | Heat accumulating type acetylene-benzene carbon black reaction furnace | 石嘴山市惠农区大明化工有限公司 | 2024-01-16 | — | — | CN | claimed |
| CN-116710516-A | Electret meltblown webs with improved filtration performance | 博里利斯股份公司 | 2023-09-05 | — | — | CN | claimed |
| CN-116334065-A | Gold-modified carbon nanocage loaded CYP450 enzyme composite material, and preparation method and application thereof | 临沂大学 | 2023-06-27 | — | — | CN | claimed |
| CN-217237752-U | Base carbon benzene protection time tester | 上海华严环境科技有限公司 | 2022-08-19 | — | — | CN | claimed |
| CN-109291451-B | Process and equipment for manufacturing colored ultrathin mica sheet | 田晓明 | 2020-09-18 | — | — | CN | claimed |
| CN-106608783-B | Method for preparing dimethylbenzene from methanol | 中国石油化工股份有限公司 | 2020-07-07 | — | — | CN | claimed |
| CN-106608781-B | The method of alcohol ether aromatic hydrocarbons coproduction ethylbenzene | 中国石油化工股份有限公司 | 2019-10-11 | — | — | CN | claimed |
| CN-110146695-A | Using the method for k nearest neighbor algorithm screening human thyroid element transporter chaff interferent | 南京理工大学 | 2019-08-20 | — | — | CN | claimed |
| CN-106946790-B | A kind of preparation method of 1,2- substituted benzimidazole analog derivative | 华侨大学 | 2019-08-06 | — | — | CN | claimed |
| EP-1306131-A2 | Cross-Coupling catalyst comprising a cyclic nitrogen ligand and process using the same | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2003-05-02 | — | — | EP | claimed |
| CN-1086186-C | Process and equipment for recovering residual dregs after production of diformamidine | HUAXIA VETERINARY PHARMACEUTIC (CN) | 2002-06-12 | — | — | CN | claimed |
| CN-1310708-A | Substituted phenylamidines with antithrombotic action | BOEHRINGER INGELHEIM PHARMA (DE) | 2001-08-29 | — | — | CN | claimed |
| CN-1247189-A | Process and equipment for recovering residual dregs after production of diformamidine | HUAXIA VETERINARY PHARMACEUTIC (CN) | 2000-03-15 | — | — | CN | claimed |
| CN-1230110-A | Cell adhesion inhibitors | BIOGEN INC (US) | 1999-09-29 | — | — | CN | claimed |
| CN-1187186-A | Substituted phenyl amindines, medicaments containing these compounds and process for producing them | THOMAE GMBH DR K (DE) | 1998-07-08 | — | — | CN | claimed |
| US-5510522-A | AMIDATION, IODINATION, METALLIZATION, RADIOFLUORINATION OF DOPA AND DERIVATIVES THEREOF; SHELF STABLE PRECURSOR, HIGH YIELDS | REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1996-04-23 | — | — | US | claimed |
| WO-1994000460-A9 | SYNTHESIS OF N-FORMYL-3,4-DI-t-BUTOXYCARBONYLOXY-6-(TRIMETHYLSTANNYL)-L-PHENYLALANINE ETHYL ESTER AND ITS REGIOSELECTIVE RADIOFLUORODESTANNYLATION TO 6-[18F]FLUORO-L-DOPA | — | 1994-02-17 | — | — | WO | claimed |
| WO-1994000460-A1 | SYNTHESIS OF N-FORMYL-3,4-DI-t-BUTOXYCARBONYLOXY-6-(TRIMETHYLSTANNYL)-L-PHENYLALANINE ETHYL ESTER AND ITS REGIOSELECTIVE RADIOFLUORODESTANNYLATION TO 6-[18F]FLUORO-L-DOPA | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1994-01-06 | — | — | WO | claimed |
| US-3932538-A | Process for producing pyrogallol and derivatives thereof | MITSUBISHI CHEMICAL INDUSTRIES, LIMITED (JA) | 1976-01-13 | — | — | US | claimed |