⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20843 | 1.00 | — | — | |
| SCHEMBL604612 | 1.00 | — | — | |
| SCHEMBL29539859 | 1.00 | GPR84 (0.68) | — | |
| Ammonia Solution, Strong SCHEMBL10664736 | 0.97 | GPR84 (0.65) | — | |
| Ethane SCHEMBL6325072 | 0.97 | GPR84 (0.65) | — | |
| Water SCHEMBL1672220 | 0.97 | GPR84 (0.65) | — | |
| Methane SCHEMBL28702836 | 0.97 | GPR84 (0.65) | — | |
| SCHEMBL28422013 | 0.93 | GPR84 (0.61) | — | |
| 3-Hydroxybutyric Acid, (+/-)- SCHEMBL1272463 | 0.91 | GPR84 (0.59) | — | |
| SCHEMBL21552564 | 0.91 | GPR84 (0.70) | — |
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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5643793-A | Method for producing optically active 3-hydroxyhexanoic acids using porcine pancreatic lipase | CHISSO CORPORATION (JP) | 1997-07-01 | — | — | US | claimed |
| JP-2312593-A | — | — | None | — | — | JP | disclosed |
| US-9040265-B2 | Oxidoreductases for the stereoselective reduction of keto compounds | IEP GMBH (DE) | 2015-05-26 | — | — | US | disclosed |
| EP-2176415-B1 | PREPARING METHOD FOR (S)-3-HYDROXYBUTYRIC ACID AND (S)-3-HYDROXYBUTYRATE ESTER USING RECOMBINANT MICROORGANISM | LG CHEMICAL LTD (KR) | 2014-05-07 | — | — | EP | disclosed |
| US-20140017743-A1 | OXIDOREDUCTASES FOR THE STEREOSELECTIVE REDUCTION OF KETO COMPOUNDS | IEP GMBH (DE) | 2014-01-16 | — | — | US | disclosed |
| US-8535918-B2 | Preparing method for (S)-3hydroxybutyric acid and (S)-3 hydroxybutyrate ester using recombinant microorganism | LG CHEM, LTD. (KR) | 2013-09-17 | — | — | US | disclosed |
| EP-2428575-A1 | Oxidoreductases for stereo-selective reduction of keto compounds | IEP GmbH (DE) | 2012-03-14 | — | — | EP | disclosed |
| EP-2428576-A1 | Oxidoreductases for stereo-selective reduction of keto compounds | IEP GmbH (DE) | 2012-03-14 | — | — | EP | disclosed |
| EP-2428574-A1 | Oxidoreductases for stereo-selective reduction of keto compounds | IEP GmbH (DE) | 2012-03-14 | — | — | EP | disclosed |
| EP-2426209-A1 | Oxidoreductases for stereo-selective reduction of keto compounds | IEP GmbH (DE) | 2012-03-07 | — | — | EP | disclosed |
| US-20040267043-A1 | Production method for optically active N-aryl-beta-amino acid compounds | AJINOMOTO CO., INC. (JP) | 2004-12-30 | — | — | US | disclosed |
| EP-1471050-A1 | Production method for optically active N-aryl-beta-amino acid compounds | Ajinomoto Co., Inc. (JP) | 2004-10-27 | — | — | EP | disclosed |
| US-6384228-B2 | EPIBATIDINE; ANALGESICS; ANIMAL EXTRACTS | NIHON MEDI-PHYSICS CO., LTD. (JP) | 2002-05-07 | — | — | US | disclosed |
| US-6379659-B1 | APPLYING (2S,3R)-2-ACYLAMINOALKANE-1,3-DIOL TO FIBER | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2002-04-30 | — | — | US | disclosed |
| US-20020010339-A1 | METHOD FOR SYNTHESIS OF HALOPYRIDYL-ACYCLOPENTANE DERIVATIVE AND INTERMEDIATE THEREOF | NIHON MEDI-PHYSICS CO., LTD. (JP) | 2002-01-24 | — | — | US | disclosed |
| EP-0920852-A2 | Keratin fiber strengthening agent and method for strengthening keratin fiber | Takasago International Corporation (JP) | 1999-06-09 | — | — | EP | disclosed |
| US-5643793-A | Method for producing optically active 3-hydroxyhexanoic acids using porcine pancreatic lipase | CHISSO CORPORATION (JP) | 1997-07-01 | — | — | US | disclosed |
| US-5275756-A | Pyrimidine ether compounds for electrooptical elements | TAKASAGO INTERNATIONAL CORPORATION (JP) | 1994-01-04 | — | — | US | disclosed |
| EP-0469893-A1 | Fluorinated pyrimidine-phenyl optically active compounds and liquid crystal compositions thereof | Takasago International Corporation (JP) | 1992-02-05 | — | — | EP | disclosed |
| JP-H02312593-A | METHOD FOR CARRYING OUT ASYMMETRIC REDUCTION REACTION OF KETONES BY BREAD YEAST | DAITO KOEKI KK | 1990-12-27 | — | — | JP | disclosed |