⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29090490 | 0.96 | — | — | |
| SCHEMBL16349268 | 0.74 | — | — | |
| SCHEMBL27967149 | 0.73 | — | — | |
| SCHEMBL27598883 | 0.73 | — | — | |
| SCHEMBL30296366 | 0.72 | — | — | |
| SCHEMBL6278266 | 0.72 | — | — | |
| SCHEMBL15711982 | 0.72 | — | — | |
| SCHEMBL27875086 | 0.72 | — | — | |
| SCHEMBL28798740 | 0.72 | — | — | |
| SCHEMBL25992987 | 0.72 | POLB (0.35) | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116507599-B | Production of 2, 4-tetramethyl cyclobutane-1, 3-diol from isobutanol using homogeneous catalyst | 伊士曼化工公司 | 2026-05-19 | — | — | CN | claimed |
| CN-1008735-B | Pyrrole ylmethyl-cyclopropyl-carbinol derivatives with replacement is a composition of active components | BAYER AG (DE) | 1990-07-11 | — | — | CN | claimed |
| CN-112198220-B | Gas sensor and method of sensing a gas phase analyte | 杜邦电子材料国际有限责任公司 | 2025-05-09 | — | — | CN | disclosed |
| CN-112198220-B | Gas sensor and method of sensing a gas phase analyte | 杜邦电子材料国际有限责任公司 | 2025-05-09 | — | — | CN | disclosed |
| CN-110944629-B | Enzyme-triggered carbon monoxide release molecules | 乔治亚州立大学研究基金会股份有限公司 | 2024-04-09 | — | — | CN | disclosed |
| US-20200216498-A1 | IMMUNOMODULATORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2020-07-09 | — | — | US | disclosed |
| CN-101665492-A | 1,6,7, 12-tetraphenyl perylene bisimide derivatives and preparation method thereof | UNIV DALIAN TECH | 2010-03-10 | — | — | CN | disclosed |
| CN-1958238-A | Method of manufacturing resin bonding grinding wheel | WUNORTON CO LTD (JP) | 2007-05-09 | — | — | CN | disclosed |
| CN-1244654-C | Coating composition | DU PONT (US) | 2006-03-08 | — | — | CN | disclosed |
| CN-1008735-B | Pyrrole ylmethyl-cyclopropyl-carbinol derivatives with replacement is a composition of active components | BAYER AG (DE) | 1990-07-11 | — | — | CN | disclosed |
| CN-1005378-B | Composition comprising substituted azolylcyclopropyl-azolylmethyl-carbinol derivatives as active ingredient | 拜尔公司 | 1989-10-11 | — | — | CN | disclosed |