⚠ 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 | |
|---|---|---|---|---|
| Tert-Butanol SCHEMBL17409545 | 1.00 | — | — | |
| Tert-Butanol SCHEMBL8915084 | 1.00 | ALDH1A1 (0.42) | — | |
| Tert-Butanol SCHEMBL6222911 | 1.00 | — | — | |
| Tert-Butanol SCHEMBL994481 | 1.00 | ALDH1A1 (0.42) | — | |
| Tert-Butanol SCHEMBL3908572 | 1.00 | ALDH1A1 (0.42) | — | |
| Tert-Butanol SCHEMBL28133384 | 0.94 | — | — | |
| Tert-Butanol SCHEMBL9785230 | 0.94 | — | — | |
| Tert-Butanol SCHEMBL28208487 | 0.94 | — | — | |
| Tert-Butanol SCHEMBL10611838 | 0.94 | — | — | |
| Tert-Butanol SCHEMBL27292163 | 0.94 | — | — |
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
Appears in 2216 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20260107628-A1 | SYNTHESIS METHOD FOR HEXAPHENYLBENZENE-BASED ORGANIC SMALL MOLECULES AND APPLICATION IN ELECTROLUMINESCENT DEVICES | TIANJIN UNIVERSITY (CN) | 2026-04-16 | — | — | US | claimed |
| CN-119371662-A | Poly tetra-thio-orthocarbonate with adjustable optical performance and preparation method thereof | 大连理工大学 | 2025-01-28 | — | — | CN | claimed |
| CN-118994244-A | Synthetic preparation method of tenofovir | 石家庄龙泽制药股份有限公司 | 2024-11-22 | — | — | CN | claimed |
| CN-118679166-A | Synthesis method of 1H-furo [3,2-b ] imidazo [4,5-d ] pyridine compound | 杭州高光制药有限公司 | 2024-09-20 | — | — | CN | claimed |
| CN-118290229-A | Method for recycling hexanediol monomer by catalytic degradation of polycarbonate diol | 中国科学院青岛生物能源与过程研究所 | 2024-07-05 | — | — | CN | claimed |
| US-20240199552-A1 | AMIDE COMPOUND AND USE THEREOF | SHENYANG UNIVERSITY OF CHEMICAL TECHNOLOGY (CN) | 2024-06-20 | — | — | US | claimed |
| CN-221084682-U | Methyl diphenyl pentene liquid crystal monomer production line | 江苏广域化学有限公司 | 2024-06-07 | — | — | CN | claimed |
| CN-117924625-A | Butadiene-styrene copolymer, preparation method and application thereof, waterproof coiled material and preparation method thereof | 中国石油化工股份有限公司 | 2024-04-26 | — | — | CN | claimed |
| CN-112645866-B | Synthesis and application of 1-benzyl-4-methyl-5-alkoxy-1, 2,3, 6-tetrahydropyridine derivative | 浙江奥翔药业股份有限公司 | 2024-03-22 | — | — | CN | claimed |
| CN-115109027-B | Degradable fluorescent molecule for photodynamic therapy, preparation method and application | 江汉大学 | 2023-12-22 | — | — | CN | claimed |
| CN-1317506-A | Conjugated biolofin and monovinylarene dual-block rubber with high wet skid resistance and low rolling resistance | RES INST OF YANSHAN PETRO CHEM (CN) | 2001-10-17 | — | — | CN | claimed |
| CN-1315461-A | Application of polychela-type trigger in preparing biblock rubber of conjugated diolefine and monovinyl arene | RES INST OF YANSHAN PETRO CHEM (CN) | 2001-10-03 | — | — | CN | claimed |
| CN-1285344-A | Process for preparation of 4-nitrodiphenylamine and 4-nitrosodiphenylamine from carbanilide | GOLDSTAR PETROCHEMICAL CO LTD (KR) | 2001-02-28 | — | — | CN | claimed |
| CN-1264714-A | Process for preparing atactic copolymer of conjugated diene and monovinyl arylhydrocarbon | RES INST OF YANSHAN PETRO CHEM (CN) | 2000-08-30 | — | — | CN | claimed |
| CN-1263117-A | Isoprene-butadiene-styrene triblock copolymer and its preparation method | RES INST BEIJING YANSHAN PETRO (CN) | 2000-08-16 | — | — | CN | claimed |
| CN-1263118-A | Butadiene-isoprene-styrene heptablock copolymer and its preparation method | RES INST BEIJING YANSHAN PETRO (CN) | 2000-08-16 | — | — | CN | claimed |
| CN-1263119-A | Isoprene-butadiene-styrene pentablock copolymer and its preparation method | RES INST BEIJING YANSHAN PETRO (CN) | 2000-08-16 | — | — | CN | claimed |
| CN-1263116-A | Butadiene-styrene triblock copolymer and its preparation method | RES INST BEIJING YANSHAN PETRO (CN) | 2000-08-16 | — | — | CN | claimed |
| CN-1263120-A | Butadiene-isoprene-styrene pentablock copolymer and its preparation method | RES INST BEIJING YANSHAN PETRO (CN) | 2000-08-16 | — | — | CN | claimed |
| WO-1993010076-A1 | SYNTHESIS AND OPTICAL RESOLUTION OF THE TAXOL SIDE CHAIN AND RELATED COMPOUNDS | THE UNIVERSITY OF MISSISSIPPI (US) | 1993-05-27 | — | — | WO | claimed |