⚠ 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 | |
|---|---|---|---|---|
| Nitrobenzene SCHEMBL1330825 | 1.00 | — | — | |
| Nitrobenzene SCHEMBL9669095 | 1.00 | — | — | |
| Nitrobenzene SCHEMBL1330714 | 1.00 | — | — | |
| Nitrobenzene SCHEMBL2255264 | 1.00 | ALDH1A1 (1.00) | — | |
| Nitrobenzene SCHEMBL2358164 | 1.00 | ALDH1A1 (1.00) | — | |
| Nitrobenzene SCHEMBL15525745 | 1.00 | ALDH1A1 (1.00) | — | |
| Nitrobenzene SCHEMBL25293390 | 0.97 | ALDH1A1 (0.94) | — | |
| Nitrobenzene SCHEMBL3888859 | 0.97 | ALDH1A1 (0.94) | — | |
| Nitrobenzene SCHEMBL10466523 | 0.97 | ALDH1A1 (0.94) | — | |
| Nitrobenzene SCHEMBL2744753 | 0.97 | ALDH1A1 (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 136959 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-20260145165-A1 | BACKSIDE POLISHING ADDITIVE FOR REDUCING ALKALI CONSUMPTION AND PREPARATION METHOD AND USE THEREOF | Han, Gengxin (US) | 2026-05-28 | — | — | US | claimed |
| CN-122080343-A | Method for synthesizing polyarylketone compound | — | 2026-05-26 | — | — | CN | claimed |
| CN-122079753-A | Method for catalyzing peroxide to be decomposed into alcohol and ketone | — | 2026-05-26 | — | — | CN | claimed |
| CN-117447329-B | Method for preparing nitrobenzaldehyde by direct oxidation of nitrotoluene | INSTITUTE OF COAL CHEMISTRY, CHINESE ACADEMY OF SCIENCES (CN) | 2026-05-26 | — | — | CN | claimed |
| CN-122079717-A | Efficient oxygen deleting reagent and application thereof in carbon resource molecular skeleton deoxidizing reconstruction | — | 2026-05-26 | — | — | CN | claimed |
| CN-122094945-A | Production of 5-HMF in nonaqueous solvents using concentration of 5-HMF prior to liquid-liquid extraction | — | 2026-05-26 | — | — | CN | claimed |
| CN-122080492-A | Phase transfer enrichment function catalyst for preparing 3-hydroxy-propanal by acrolein hydration reaction, preparation method and application thereof | — | 2026-05-26 | — | — | CN | claimed |
| CN-120208394-B | Method for removing nitro compounds in water through pyrite-mediated atomic hydrogen reduction | SUN YAT-SEN UNIVERSITY (CN) | 2026-05-26 | — | — | CN | claimed |
| CN-122079399-A | Method and system for treating organic wastewater under action of strong electric field | — | 2026-05-26 | — | — | CN | claimed |
| CN-122071405-A | Efficient and energy-saving phloroglucinol preparation process | 湖北昕天康药业有限公司 | 2026-05-22 | — | — | CN | claimed |
| US-3948667-A | HOMO- AND CO-POLYMERS OF CYCLIZED BUTADIENE AND A CROSSLINKING AGENT | JAPAN SYNTHETIC RUBBER COMPANY LIMITED (JA) | 1976-04-06 | — | — | US | claimed |
| US-3948596-A | Oxidation dye for keratinic fibers containing 2-halo-5-acetaminophenol as a coupler | SOCIETE ANONYME DITE: L'OREAL (FR) | 1976-04-06 | — | — | US | claimed |
| US-3943136-A | Process for preparing 3,3-thiobis (2-methoxy-1-azabenzanthrone | MONTEDISON S.P.A., (IT) | 1976-03-09 | — | — | US | claimed |
| US-3941768-A | One step diazotization coupling process | CIBA-GEIGY AG (CH) | 1976-03-02 | — | — | US | claimed |
| US-3937741-A | PRODUCTION OF HYDROQUINONE | KOPPERS COMPANY, INC. (US) | 1976-02-10 | — | — | US | claimed |
| US-3936469-A | Process for preparing N-carboxylic anhydrides of amino acids | KYOWA HAKKO KOGYO KABUSHIKI KAISHA (JA) | 1976-02-03 | — | — | US | claimed |
| US-3935283-A | MULTISTAGE, HYDROGENATION OF NITROBENZENE, PLATINUM, PLATINUM SULFIDE OR MOLYBDENUM SULFIDE CATALYST | KOPPERS COMPANY, INC. (US) | 1976-01-27 | — | — | US | claimed |
| US-3935472-A | Thin film liquid waveguide optical converter | BELL TELEPHONE LABORATORIES, INCORPORATED (US) | 1976-01-27 | — | — | US | claimed |
| US-3933722-A | Meet extrudable polyacetylene copolymer blends | GENERAL ELECTRIC COMPANY (US) | 1976-01-20 | — | — | US | claimed |
| US-3933957-A | Process for producing shaped articles from an acetylenic polymer | GENERAL ELECTRIC COMPANY (US) | 1976-01-20 | — | — | US | claimed |