⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11128165 | 0.82 | — | — | |
| SCHEMBL330407 | 0.78 | — | — | |
| SCHEMBL1301286 | 0.78 | — | — | |
| Tert-Butanol SCHEMBL4348456 | 0.72 | — | — | |
| Tert-Butanol SCHEMBL8169028 | 0.70 | — | — | |
| SCHEMBL21596510 | 0.70 | — | — | |
| SCHEMBL6594929 | 0.70 | — | — | |
| Tert-Butanol SCHEMBL6194876 | 0.70 | ALDH1A1 (0.61) | — | |
| SCHEMBL6595292 | 0.70 | — | — | |
| Tert-Butanol SCHEMBL1204871 | 0.70 | ALDH1A1 (0.61) | — |
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 198 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3710159-A1 | CATALYST COMPONENTS FOR PROPYLENE POLYMERIZATION | W. R. Grace & Co. - Conn. (US) | 2020-09-23 | — | — | EP | claimed |
| US-20180355094-A1 | SUGAR-BASED POLYURETHANES, METHODS FOR THEIR PREPARATION, AND METHODS OF USE THEREOF | INNOVATIVE URETHANE, LLC (US) | 2018-12-13 | — | — | US | claimed |
| US-20170247497-A1 | SUGAR-BASED POLYURETHANES, METHODS FOR THEIR PREPARATION, AND METHODS OF USE THEREOF | INNOVATIVE URETHANE, LLC (US) | 2017-08-31 | — | — | US | claimed |
| US-20050178996-A1 | Solvent-based fluorinated water and oil repellent and process for producing the same | JINTEX CORPORATION LTD. (TW) | 2005-08-18 | — | — | US | claimed |
| EP-0807134-B1 | BLOW-MOLDABLE RIGID THERMOPLASTIC POLYURETHANE RESINS | DOW CHEMICAL CO (US) | 1999-09-01 | — | — | EP | claimed |
| EP-0648237-B1 | POLYURETHANE/POLYUREA ELASTOMERS | MINNESOTA MINING & MFG (US) | 1997-11-05 | — | — | EP | claimed |
| EP-0648237-A1 | POLYURETHANE/POLYUREA ELASTOMERS | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1995-04-19 | — | — | EP | claimed |
| WO-1994000504-A1 | POLYURETHANE/POLYUREA ELASTOMERS | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1994-01-06 | — | — | WO | claimed |
| EP-0268849-B1 | Poly(aminoaromatic) compounds | DOW CHEMICAL CO (US) | 1993-10-20 | — | — | EP | claimed |
| US-4699968-A | HIGH DENSITY, HIGH STRENGTH ELASTOMERS | THE FIRESTONE TIRE & RUBBER COMPANY (US) | 1987-10-13 | — | — | US | claimed |
| US-4022718-A | 2,3-DIBROMO-2-BUTENEDIOL-1,4 | GAF CORPORATION (US) | 1977-05-10 | — | — | US | claimed |
| JP-57133111-A | — | — | None | — | — | JP | disclosed |
| EP-4172230-B1 | POLYURETHANES BASED ON SIDE CHAIN DIOL- AND DIAMINOPOLYPHOSPHAZENES AND THEIR HYDROGELS | COVESTRO DEUTSCHLAND AG (DE) | 2024-05-22 | — | — | EP | disclosed |
| EP-4172231-B1 | POLYURETHANES BASED ON TERMINAL DIOL- AND DIAMINOPOLYPHOSPHAZENES AND THEIR HYDROGELS | COVESTRO DEUTSCHLAND AG (DE) | 2024-05-22 | — | — | EP | disclosed |
| US-11963433-B2 | Organic electroluminescent element | THE UNIVERSITY OF TOKYO (JP) | 2024-04-16 | — | — | US | disclosed |
| US-4115321-A | Catalyst systems containing N,N-dimethylaminoalkoxypropionitriles for polyurethane foam formulation | UNION CARBIDE CORPORATION (US) | 1978-09-19 | — | — | US | disclosed |
| US-4038210-A | BETA-AMINO NITRILE CATALYSTS FOR POLYURETHANE PREPARATION | UNION CARBIDE CORPORATION (US) | 1977-07-26 | — | — | US | disclosed |
| US-4033911-A | Process for catalyzing polyurethane foam formation using N,N-dimethyl-aminoalkoxy-propionitriles | UNION CARBIDE CORPORATION (US) | 1977-07-05 | — | — | US | disclosed |
| US-3993833-A | FLUOROALIPHATIC FOAM STABILIZER | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1976-11-23 | — | — | US | disclosed |
| US-3945981-A | COATINGS | UNIROYAL, INC. (US) | 1976-03-23 | — | — | US | disclosed |