⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29881687 | 0.91 | TSHR (0.31) | — | |
| SCHEMBL18407845 | 0.77 | — | — | |
| SCHEMBL6897021 | 0.76 | — | — | |
| SCHEMBL9845264 | 0.76 | — | — | |
| SCHEMBL30762 | 0.76 | — | — | |
| Ammonia Solution, Strong SCHEMBL28118769 | 0.74 | PIK3CD (0.47) | — | |
| Hydrochloric Acid SCHEMBL7162864 | 0.74 | PIK3CD (0.47) | — | |
| Methane SCHEMBL27440503 | 0.74 | PIK3CD (0.47) | — | |
| SCHEMBL7648117 | 0.73 | CYP3A4 (0.35) | — | |
| SCHEMBL29212561 | 0.72 | PIK3CD (0.42) | — |
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 87 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-4817496-B2 | — | — | 2011-11-16 | — | — | JP | claimed |
| JP-4729173-B2 | — | — | 2011-07-20 | — | — | JP | claimed |
| US-7307188-B2 | Purification of carboxylic acids by complexation with selective solvents | GTC TECHNOLOGY, INC. (US) | 2007-12-11 | — | — | US | claimed |
| JP-2007532569-A | — | — | 2007-11-15 | — | — | JP | claimed |
| CN-101001825-A | Purification of carboxylic acids by complexation with selective solvents | GTC TECHNOLOGY INC (US) | 2007-07-18 | — | — | CN | claimed |
| EP-1735260-A2 | PURIFICATION OF CARBOXYLIC ACIDS BY COMPLEXATION WITH SELECTIVE SOLVENTS | GTC Technology, Inc (US) | 2006-12-27 | — | — | EP | claimed |
| WO-2006088470-A2 | PURIFICATION OF CARBOXYLIC ACIDS BY COMPLEXATION WITH SELECTIVE SOLVENTS | GTC TECHNOLOGY INC. (US) | 2006-08-24 | — | — | WO | claimed |
| CN-1231447-C | Method for purifying isophthalic acid by crystallization | HFM INT INC (US) | 2005-12-14 | — | — | CN | claimed |
| US-20050228195-A1 | Purification of carboxylic acids by complexation with selective solvents | GTC TECHNOLOGY, INC. | 2005-10-13 | — | — | US | claimed |
| CN-1191224-C | Method for preparing purified terephthalic acid and isophthalic acid from mixed xylenes | HFM INT INC (US) | 2005-03-02 | — | — | CN | claimed |
| WO-1999065854-A1 | METHOD TO REDUCE CARBOXYBENZALDEHYDE ISOMERS IN TEREPHTHALIC ACID OR ISOPHTHALIC ACID | HFM INTERNATIONAL, INC. (US) | 1999-12-23 | — | — | WO | claimed |
| WO-1999062857-A1 | METHOD FOR PREPARING PURIFIED TEREPHTHALIC ACID AND ISOPHTHALIC ACID FROM MIXED XYLENES | HFM INTERNATIONAL, INC. (US) | 1999-12-09 | — | — | WO | claimed |
| WO-1999057090-A1 | PROCESS FOR PURIFYING ISOPHTHALIC ACID BY CRYSTALLIZATION | HFM INTERNATIONAL, INC. (US) | 1999-11-11 | — | — | WO | claimed |
| US-5929274-A | DISSOLVING THE CRUDE ACID BY HEATING IN A SOLVENT, COOLING TO CRYSTALLIZE AND SEPARATING; OXIDIZING THE FILTERED SOLUTION, DESOLVENTIZING BY EVAPORATION, COOLING TO CRYSTALIZE AND CIRCULATING THE MOTHER LIQUOR | HFM INTERNATIONAL, INC. (US) | 1999-07-27 | — | — | US | claimed |
| CN-1192198-A | Method and apparatus for preparing purified terephthalic acid | HFM INT INC (US) | 1998-09-02 | — | — | CN | claimed |
| US-5767311-A | FILTRATION; FORMING FILTER CAKE; CRYSTALLIZATION | GLITSCH INTERNATIONAL, INC. | 1998-06-16 | — | — | US | claimed |
| WO-1998024749-A1 | METHOD AND APPARATUS FOR PREPARING PURIFIED TEREPHTHALIC ACID | HFM INTERNATIONAL, INC. (US) | 1998-06-11 | — | — | WO | claimed |
| US-5003082-A | Reacting a lactam with hydrogen sulfide in the presence of an inorganic catalyst | PHILLIPS PETROLEUM COMPANY (US) | 1991-03-26 | — | — | US | claimed |
| US-4990628-A | Reacting lactam with hydrogen sulfide in presence of group 8 metals or compounds on alumina; support; sulfiding | PHILLIPS PETROLEUM COMPANY (US) | 1991-02-05 | — | — | US | claimed |
| US-4956476-A | Catalytic reaction of a lactam with hydrogen sulfide to produce a thiolactam, alumina is the catalyst | PHILLIPS PETROLEUM COMPANY (US) | 1990-09-11 | — | — | US | claimed |