⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3437138 | 0.81 | — | — | |
| SCHEMBL11132132 | 0.80 | TGFBR1 (0.39) | — | |
| SCHEMBL2356386 | 0.79 | — | — | |
| SCHEMBL11555339 | 0.77 | — | — | |
| Charcoal, Activated SCHEMBL3490610 | 0.77 | — | — | |
| SCHEMBL300034 | 0.77 | — | — | |
| SCHEMBL8956995 | 0.76 | TSHR (0.38) | — | |
| Hydrochloric Acid SCHEMBL6415353 | 0.75 | TSHR (0.50) | — | |
| SCHEMBL3128631 | 0.74 | — | — | |
| SCHEMBL170265 | 0.74 | — | — |
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 52 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4644017-A | USING AMINO ALKYL UREA CATALYST | BAYER AKTIENGESELLSCHAFT (DE) | 1987-02-17 | — | — | US | claimed |
| EP-3954722-A1 | PROCESS AND COMPOSITION FOR THE PRODUCTION OF FLEXIBLE POLYURETHANE FOAM | Evonik Operations GmbH (DE) | 2022-02-16 | — | — | EP | disclosed |
| US-20220033603-A1 | PROCESS AND COMPOSITION FOR THE PRODUCTION OF FLEXIBLE POLYURETHANE FOAM | EVONIK OPERATIONS GMBH (DE) | 2022-02-03 | — | — | US | disclosed |
| US-10988566-B2 | Delayed action gelling catalyst compositions and methods for making polyurethane polymers | EVONIK OPERATIONS GMBH (DE) | 2021-04-27 | — | — | US | disclosed |
| EP-3292162-B1 | DELAYED ACTION GELLING CATALYST COMPOSITIONS AND METHODS FOR MAKING POLYURETHANE POLYMERS | EVONIK OPERATIONS GMBH (DE) | 2021-01-20 | — | — | EP | disclosed |
| US-10815351-B2 | Polyurethane foam production process, pre-mix, formulation, and product | EVONIK OPERATIONS GMBH (DE) | 2020-10-27 | — | — | US | disclosed |
| EP-2831130-B1 | POLYURETHANE FOAM PRODUCTION PROCESS, PRE-MIX, FORMULATION, AND PRODUCT | EVONIK OPERATIONS GMBH (DE) | 2020-01-08 | — | — | EP | disclosed |
| US-20190100638-A1 | POLYURETHANE FOAM PRODUCTION PROCESS, PRE-MIX, FORMULATION, AND PRODUCT | EVONIK OPERATIONS GMBH (DE) | 2019-04-04 | — | — | US | disclosed |
| US-20190016844-A1 | DELAYED ACTION GELLING CATALYST COMPOSITIONS AND METHODS FOR MAKING POLYURETHANE POLYMERS | EVONIK OPERATIONS GMBH (DE) | 2019-01-17 | — | — | US | disclosed |
| US-10144811-B2 | Polyurethane foam production process, pre-mix formulation, and product | EVONIK DEGUSSA GMBH (DE) | 2018-12-04 | — | — | US | disclosed |
| US-4623652-A | ADRENERGIC BLOCKING AGENTS | AMERICAN HOSPITAL SUPPLY CORPORATION (US) | 1986-11-18 | — | — | US | disclosed |
| EP-0093155-B1 | ESTERS OF ARYLOXYPROPANOLAMINE DERIVATIVES AND USE AS BETA-ADRENERGIC BLOCKING AGENTS | AMERICAN HOSPITAL SUPPLY CORPORATION (US) | 1986-08-27 | — | — | EP | disclosed |
| US-4582855-A | Aromatic and esters of hydroxypropylamines | AMERICAN HOSPITAL SUPPLY CORPORATION (US) | 1986-04-15 | — | — | US | disclosed |
| EP-0131006-A4 | ESTERS OF 3-(3-SUBSTITUTED-AMINO-2-HYDROXYPROPOXY)-4-SUBSTITUTED-1,2,5-THIADIAZOLE DERIVATIVES. | AMERICAN HOSPITAL SUPPLY CORP (US) | 1985-06-06 | — | — | EP | disclosed |
| US-4508725-A | BETA-ADRENERGIC BLOCKING AGENTS; GLAUCOMA TREATMENT | AMERICAN HOSPITAL SUPPLY CORPORATION (US) | 1985-04-02 | — | — | US | disclosed |
| EP-0131006-A1 | ESTERS OF 3-(3-SUBSTITUTED-AMINO-2-HYDROXYPROPOXY)-4-SUBSTITUTED-1,2,5-THIADIAZOLE DERIVATIVES. | AMERICAN HOSPITAL SUPPLY CORP (US) | 1985-01-16 | — | — | EP | disclosed |
| WO-1984002525-A1 | ESTERS OF 3-(3-SUBSTITUTED-AMINO-2-HYDROXYPROPOXY)-4-SUBSTITUTED-1,2,5-THIADIAZOLE DERIVATIVES | AMERICAN HOSPITAL SUPPLY CORP (US) | 1984-07-05 | — | — | WO | disclosed |
| EP-0093765-A4 | 2-HYDROXYPROPYLAMINE ARYL ESTER DERIVATIVES. | AMERICAN HOSPITAL SUPPLY CORP (US) | 1984-04-27 | — | — | EP | disclosed |
| EP-0093765-A1 | 2-HYDROXYPROPYLAMINE ARYL ESTER DERIVATIVES. | AMERICAN HOSPITAL SUPPLY CORP (US) | 1983-11-16 | — | — | EP | disclosed |
| WO-1983001770-A1 | 2-HYDROXYPROPYLAMINE ARYL ESTER DERIVATIVES | AMERICAN HOSPITAL SUPPLY CORP (US) | 1983-05-26 | — | — | WO | disclosed |