⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3168632 | 1.00 | CA1 (0.42) | — | |
| SCHEMBL3415461 | 1.00 | CA1 (0.42) | — | |
| Cyclohexane SCHEMBL10804991 | 1.00 | CA1 (0.42) | — | |
| SCHEMBL3416195 | 1.00 | CA1 (0.42) | — | |
| SCHEMBL3415460 | 1.00 | CA1 (0.42) | — | |
| SCHEMBL3415468 | 1.00 | CA1 (0.42) | — | |
| SCHEMBL3413582 | 1.00 | — | — | |
| SCHEMBL8530196 | 1.00 | CA1 (0.42) | — | |
| SCHEMBL4473841 | 1.00 | CA1 (0.42) | — | |
| SCHEMBL1683865 | 0.96 | — | — |
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 4701 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 |
|---|---|---|---|---|---|---|---|
| CN-122079845-A | Method and system for preparing cyclohexyl hydroperoxide by oxidizing cyclohexane | — | 2026-05-26 | — | — | CN | claimed |
| CN-122059919-A | Continuous process and system for preparing propylene carbonate from propylene and carbon dioxide | 中国石油大学(华东) | 2026-05-19 | — | — | CN | claimed |
| US-12552741-B2 | Production of dinitriles | INV NYLON CHEMICALS AMERICAS, LLC (US) | 2026-02-17 | — | — | US | claimed |
| CN-120058474-A | Method and device for improving oxidation yield of cyclohexanol and cyclohexanone prepared by oxidation of cyclohexane | 长沙兴和新材料有限公司 | 2025-05-30 | — | — | CN | claimed |
| CN-119977755-A | Method for producing cyclohexanone and cyclohexanol by oxidizing cyclohexane | 长沙兴和新材料有限公司 | 2025-05-13 | — | — | CN | claimed |
| CN-119897159-A | Titanium-silicon molecular sieve, preparation method thereof, catalyst for preparing o-diol by catalyzing olefin oxidation and application of catalyst | 中国石油化工股份有限公司 | 2025-04-29 | — | — | CN | claimed |
| CN-222694700-U | Cyclohexyl hydroperoxide homogeneous decomposition system | 湖北三宁化工股份有限公司 | 2025-04-01 | — | — | CN | claimed |
| CN-116459840-B | Cobalt-based perovskite oxide catalyst and preparation and application thereof | 湘潭大学 | 2025-02-28 | — | — | CN | claimed |
| CN-119504406-A | Method and production system for preparing adipic acid by oxidizing cyclohexane | 扬州大学 | 2025-02-25 | — | — | CN | claimed |
| CN-119462361-A | Method for preparing adipic acid by adopting microchannel reactor | 扬州大学 | 2025-02-18 | — | — | CN | claimed |
| US-3983143-A | Epoxidation of olefins with less stable organic hydroperoxides by using an alcohol stabilizing agent | ATLANTIC RICHFIELD COMPANY (US) | 1976-09-28 | — | — | US | claimed |
| US-3957876-A | TO CYCLOHEXANE HYDROPEROXIDE, COBALT CATALYST | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1976-05-18 | — | — | US | claimed |
| US-3956397-A | Process for extracting cycloaliphatic hydroperoxides | RHONE-POULENC INDUSTRIES (FR) | 1976-05-11 | — | — | US | claimed |
| US-3953526-A | Synthesis of hydroquinone | ATLANTIC RICHFIELD COMPANY (US) | 1976-04-27 | — | — | US | claimed |
| US-3950287-A | CURING, AMINES, FREE RADICAL CATALYSTS | ASHLAND OIL, INC. (US) | 1976-04-13 | — | — | US | claimed |
| US-3949004-A | FROM A HYDROCARBON AND OXYGEN, STABILIZER OF TERT-BUTYL ALCOHOL AND WATER | ATLANTIC RICHFIELD COMPANY (US) | 1976-04-06 | — | — | US | claimed |
| US-3949003-A | FROM A HYDROCARBON AND OXYGEN, TERTIARY ALCOHOL CATALYST | ZAJACEK JOHN G | 1976-04-06 | — | — | US | claimed |
| US-3947490-A | Process for preparing omega-formyloxy-alkanals | RHONE-POULENC S.A. (FR) | 1976-03-30 | — | — | US | claimed |
| US-3937735-A | PROCESS FOR THE PREPARATION OF CYCLOHEXANONE | STAMICARBON B.V. (NL) | 1976-02-10 | — | — | US | claimed |
| US-3935278-A | MOLYBDENUM OR VANADIUM CONTAINING CATALYST | ATLANTIC RICHFIELD COMPANY (US) | 1976-01-27 | — | — | US | claimed |