Known targets — ChEMBL curated mechanism
MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Benzene. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
⚠ 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 SCHEMBL11439058 | 1.00 | TSHR (0.67) | — | |
| Benzene SCHEMBL28158931 | 0.95 | TSHR (0.60) | — | |
| Benzene SCHEMBL28183512 | 0.95 | TSHR (0.60) | — | |
| Benzene SCHEMBL27960469 | 0.95 | TSHR (0.60) | — | |
| Benzene SCHEMBL27579085 | 0.95 | TSHR (0.60) | — | |
| Benzene SCHEMBL7268462 | 0.95 | TSHR (0.60) | — | |
| Benzene SCHEMBL10997806 | 0.95 | TSHR (0.60) | — | |
| Benzene SCHEMBL932156 | 0.95 | TSHR (0.60) | — | |
| Benzene SCHEMBL8985498 | 0.95 | TSHR (0.60) | — | |
| Benzene SCHEMBL27992094 | 0.95 | TSHR (0.60) | — |
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 2684 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-121569944-A | Shepherd's purse essence and preparation method and application thereof | 江西省华宝孔雀食品科技发展有限公司 | 2026-02-27 | — | — | CN | claimed |
| US-12522779-B2 | Method for reduction of abnormal combustion events | INFINEUM INTERNATIONAL LIMITED (US) | 2026-01-13 | — | — | US | claimed |
| US-20250333439-A1 | PURIFIED PROTEIN COMPOSITIONS AND METHODS OF PRODUCTION | CLARA FOODS CO. (US) | 2025-10-30 | — | — | US | claimed |
| EP-4368689-B1 | POLYMERIC SURFACTANTS FOR IMPROVED EMULSION AND FLOW PROPERTIES AT LOW TEMPERATURES | AFTON CHEMICAL CORP (US) | 2025-09-17 | — | — | EP | claimed |
| CN-119931146-A | High-efficiency degradation and regeneration method for resin matrix composite material | 哈尔滨工业大学 | 2025-05-06 | — | — | CN | claimed |
| CN-110590996-B | Reflux precipitation polymerization preparation method and application of polymer microsphere containing sulfonic group | 湖南工学院 | 2024-09-20 | — | — | CN | claimed |
| WO-2024159022-A2 | PURIFIED PROTEIN COMPOSITIONS AND METHODS OF PRODUCTION | CLARA FOODS CO. (US) | 2024-08-02 | — | — | WO | claimed |
| EP-4397738-A1 | METHOD FOR REDUCTION OF ABNORMAL COMBUSTION EVENTS | Infineum International Limited (GB) | 2024-07-10 | — | — | EP | claimed |
| CN-118136787-B | Method for preparing sodium ion battery negative electrode by bamboo wood and sodium ion battery negative electrode | 鑫享电港科技有限公司 | 2024-07-05 | — | — | CN | claimed |
| US-20240218284-A1 | Method for Reduction of Abnormal Combustion Events | INFINEUM INTERNATIONAL LIMITED (GB) | 2024-07-04 | — | — | US | claimed |
| CN-1141719-A | Compound organic phosphorus pesticide and preparation method thereof | DONGFANG FARM CHEMICALS FACTOR (CN) | 1997-02-05 | — | — | CN | claimed |
| CN-1086082-A | High-efficient insecticide-\" mieshaling \ | WANG BAOSHENG (CN) | 1994-05-04 | — | — | CN | claimed |
| EP-0373549-B1 | AMINO ACID DERIVATIVES WITH ENZYME-INHIBITING PROPERTIES, PROCESS TO SYNTHETISE THEM, COMPOSITION CONTAINING THEM AND THEIR USE | HOECHST AKTIENGESELLSCHAFT (DE) | 1993-09-01 | — | — | EP | claimed |
| EP-0513703-A2 | Carbamate esters of eseroline having anticholinesterase activity, a process for their preparation and relative pharmaceutical compositions containing them as the active principle | MAGIS FARMACEUTICI S.p.A. (IT) | 1992-11-19 | — | — | EP | claimed |
| EP-0373549-A2 | Amino acid derivatives with enzyme-inhibiting properties, process to synthetise them, composition containing them and their use | HOECHST AKTIENGESELLSCHAFT (DE) | 1990-06-20 | — | — | EP | claimed |
| CN-87102647-A | CONTRACEPTIVE COMPOSITION | — | 1987-11-18 | — | — | CN | claimed |
| EP-0027023-B1 | FURYL INTERMEDIATES OF CARDENOLIDES, THEIR SYNTHESIS AND PRODUCTION OF CARDENOLIDES AND THEIR ISOMERS THEREFROM | Advance Biofactures Corporation (US) | 1986-02-05 | — | — | EP | claimed |
| EP-0027023-A1 | Furyl intermediates of cardenolides, their synthesis and production of cardenolides and their isomers therefrom | Advance Biofactures Corporation (US) | 1981-04-15 | — | — | EP | claimed |
| US-4259240-A | Synthesis of furyl intermediates, and cardenolides and their isomers prepared therefrom | ADVANCE BIOFACTURES CORPORATION (US) | 1981-03-31 | — | — | US | claimed |
| US-4045565-A | TREATING LEUKEMIAS, TUMORS, AND CARDIAC DISORDERS; DEMETHYLATING A 9-METHOXY-ELLIPTICINE WITH PYRIDINE HYDROCHLORIDE | ETABLISSEMENT PUBLIC DIT: AGENCE NATIONALE DE VALORISATION DE LA RECHERCHE (ANVAR) (FR) | 1977-08-30 | — | — | US | claimed |