⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11121120 | 0.74 | ALDH1A1 (0.31) | — | |
| SCHEMBL6835317 | 0.74 | ALDH1A1 (0.31) | — | |
| SCHEMBL6551498 | 0.74 | ALDH1A1 (0.31) | — | |
| SCHEMBL11132785 | 0.70 | KDM4E (0.31) | — | |
| SCHEMBL17239391 | 0.68 | NOS3 (0.30) | — | |
| SCHEMBL17239392 | 0.68 | NOS3 (0.30) | — | |
| SCHEMBL2990913 | 0.68 | — | — | |
| SCHEMBL4854679 | 0.66 | USP2 (0.33) | — | |
| SCHEMBL1169972 | 0.65 | — | — | |
| SCHEMBL11330951 | 0.64 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115038762-A | Composition and method for manufacturing fireproof ethylene propylene diene monomer EPDM rubber | 卡莱尔建筑材料有限公司 | 2022-09-09 | — | — | CN | disclosed |
| WO-2007052048-A2 | IMPROVEMENTS IN MATERIALS FOR USE IN SUBTERRANEAN FORMATIONS | DOWNHOLE FLUID SOLUTIONS LIMITED (GB) | 2007-05-10 | — | — | WO | disclosed |
| CN-1064289-A | Be applicable to the concrete bottom-coating of polyester coatings | GRACE W R & CO (US) | 1992-09-09 | — | — | CN | disclosed |
| EP-0166801-A1 | Surface treatment for tack reduction of elastomer surfaces | THE FIRESTONE TIRE & RUBBER COMPANY (US) | 1986-01-08 | — | — | EP | disclosed |
| US-4521479-A | ANTISTICKING AGENTS FOR ETHYLENE-PROPYLENE-DIENE TERPOLYMER | THE FIRESTONE TIRE & RUBBER COMPANY (US) | 1985-06-04 | — | — | US | disclosed |
| US-4316978-A | Synthesis of substituted cyclopentadienes and cyclopentadiene-functionalized polymers | KENNEDY JOSEPH P | 1982-02-23 | — | — | US | disclosed |
| US-4246373-A | ALUMINUM CYCLOPENTADIENYL COMPOUNDS ENDCAP AND CAN CROSSLINK CHLORO- OR BROMOPOLYMERS | KENNEDY JOSEPH P | 1981-01-20 | — | — | US | disclosed |
| US-4210737-A | Synthesis of substituted cyclopentadienes and cyclopentadiene-functionalized polymers | CASTNER KENNETH F (US) | 1980-07-01 | — | — | US | disclosed |
| US-4138441-A | Synthesis of substituted cyclopentadienes and cyclopentadiene-functionalized polymers | KENNEDY JOSEPH P | 1979-02-06 | — | — | US | disclosed |
| US-3993626-A | Production of ethyl cellulose-compatible phenol-modified hydrocarbon resins for use in printing inks | NEVILLE CHEMICAL COMPANY (US) | 1976-11-23 | — | — | US | disclosed |