⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11042921 | 0.82 | ALDH1A1 (0.45) | — | |
| SCHEMBL10899437 | 0.80 | — | — | |
| SCHEMBL28160824 | 0.77 | — | — | |
| SCHEMBL1700913 | 0.77 | ALDH1A1 (0.43) | — | |
| SCHEMBL38659612 | 0.76 | ALDH1A1 (0.41) | — | |
| Nitric Acid SCHEMBL8584436 | 0.76 | ALDH1A1 (0.41) | — | |
| SCHEMBL8777211 | 0.74 | ALDH1A1 (0.40) | — | |
| SCHEMBL28086990 | 0.74 | ALDH1A1 (0.40) | — | |
| SCHEMBL10935741 | 0.74 | TSHR (0.46) | — | |
| SCHEMBL8661349 | 0.73 | — | — |
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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115521185-A | Composite modified double-base propellant | 西安近代化学研究所 | 2022-12-27 | — | — | CN | claimed |
| CN-110483752-B | Poly (2-methyl-2-nitropropanediol adipate), preparation method and application thereof | 西安近代化学研究所 | 2021-05-18 | — | — | CN | claimed |
| US-7595424-B2 | Method for producing aromatic amines or aliphatic amino alcohols | BASF AKTIENGESELLSCHAFT (DE) | 2009-09-29 | — | — | US | claimed |
| US-4416734-A | Separation of nitroalkanol by azeotropic distillation | ANGUS CHEMICAL COMPANY (US) | 1983-11-22 | — | — | US | claimed |
| CN-115521185-A | Composite modified double-base propellant | 西安近代化学研究所 | 2022-12-27 | — | — | CN | disclosed |
| CN-115521185-A | Composite modified double-base propellant | 西安近代化学研究所 | 2022-12-27 | — | — | CN | disclosed |
| CN-110483752-B | Poly (2-methyl-2-nitropropanediol adipate), preparation method and application thereof | 西安近代化学研究所 | 2021-05-18 | — | — | CN | disclosed |
| CN-110483752-B | Poly (2-methyl-2-nitropropanediol adipate), preparation method and application thereof | 西安近代化学研究所 | 2021-05-18 | — | — | CN | disclosed |
| EP-1805561-B1 | ANTIREFLECTIVE COMPOSITIONS FOR PHOTORESISTS | MERCK PATENT GMBH (DE) | 2018-10-24 | — | — | EP | disclosed |
| CN-105188904-A | Apparatus and method for continuous reaction of liquid with gas | BASF SE | 2015-12-23 | — | — | CN | disclosed |
| CN-105008037-A | Device and method for the continuous reaction of liquids with gases | BASF SE | 2015-10-28 | — | — | CN | disclosed |
| US-7691556-B2 | Antireflective compositions for photoresists | AZ ELECTRONIC MATERIALS USA CORP. (US) | 2010-04-06 | — | — | US | disclosed |
| WO-2006030320-A2 | ANTIREFLECTIVE COMPOSITIONS FOR PHOTORESISTS | AZ ELECTRONIC MATERIALS USA CORP. (DE) | 2006-03-23 | — | — | WO | disclosed |
| US-20060058468-A1 | Antireflective compositions for photoresists | MERCK PATENT GMBH (DE) | 2006-03-16 | — | — | US | disclosed |
| US-20060057501-A1 | Antireflective compositions for photoresists | AZ ELECTRONIC MATERIALS USA CORP. | 2006-03-16 | — | — | US | disclosed |
| US-4678549-A | Process for making amino alcohols by electrochemical reduction of nitro alcohols | L'AIR LIQUIDE, SOCIETE ANONYME POUR L'ETUDE ET L'EXPLOITATION DES PROCEDES GEORGES CLAUDE (FR) | 1987-07-07 | — | — | US | disclosed |
| US-4416734-A | Separation of nitroalkanol by azeotropic distillation | ANGUS CHEMICAL COMPANY (US) | 1983-11-22 | — | — | US | disclosed |
| EP-0006745-B1 | NITRO-CONTAINING ESTERS OF A SUBSTITUTED PHENYLPROPIONIC ACID, COMPOSITIONS CONTAINING THEM AS STABILIZING AGENT AGAINST OXIDATIVE DEGRADATION, AND STABILIZER COMPOSITIONS | UNIROYAL, INC. (US) | 1982-11-10 | — | — | EP | disclosed |
| EP-0006745-A1 | Nitro-containing esters of a substituted phenylpropionic acid, compositions containing them as stabilizing agent against oxidative degradation, and stabilizer compositions | UNIROYAL, INC. (US) | 1980-01-09 | — | — | EP | disclosed |
| US-4153597-A | STABILIZERS | UNIROYAL, INC. (US) | 1979-05-08 | — | — | US | disclosed |