⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL458648 | 1.00 | — | — | |
| SCHEMBL1359905 | 1.00 | — | — | |
| SCHEMBL1623516 | 1.00 | — | — | |
| SCHEMBL7612608 | 1.00 | — | — | |
| SCHEMBL13815181 | 1.00 | — | — | |
| SCHEMBL5173240 | 1.00 | — | — | |
| SCHEMBL7062078 | 1.00 | — | — | |
| Deaminohydroxyvaline SCHEMBL31121007 | 0.93 | TSHR (0.41) | — | |
| SCHEMBL14661349 | 0.84 | TSHR (0.43) | — | |
| SCHEMBL14661690 | 0.84 | TSHR (0.43) | — |
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 19 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20150038333-A1 | PLANT PROTECTIVE COMPOSITION CONTAINING ALPHA-HYDROXY ACIDS | HELMHOLTZ ZENTRUM MÜNCHEN DEUTSCHES FORSCHUNGSZENT -RUN FÜR GESUNDHEIT UND (DE) | 2015-02-05 | — | — | US | disclosed |
| EP-2736331-A1 | PLANT PROTECTIVE COMPOSITION CONTAINING ALPHA-HYDROXY ACIDS | Helmholtz Zentrum München Deutsches Forschungszentrum für Gesundheit und Umwelt (GmbH) (DE) | 2014-06-04 | — | — | EP | disclosed |
| WO-2013014245-A1 | PLANT PROTECTIVE COMPOSITION CONTAINING ALPHA-HYDROXY ACIDS | HELMHOLTZ ZENTRUM MÜNCHEN DEUTSCHES FORSCHUNGSZENTRUM FÜR GESUNDHEIT UND UMWELT (GMBH) (DE) | 2013-01-31 | — | — | WO | disclosed |
| US-7807418-B2 | Method for producing hybrid polyketide synthases | BIOTICA TECHNOLOGY LIMITED (GB) | 2010-10-05 | — | — | US | disclosed |
| EP-2182067-A2 | Hybrid polyketide synthases | Biotica Technology Limited (GB) | 2010-05-05 | — | — | EP | disclosed |
| EP-0910633-B1 | Hybrid polyketide synthase I gene | BIOTICA TECH LTD (GB) | 2009-12-09 | — | — | EP | disclosed |
| US-6960453-B1 | Hybrid polyketide synthases combining heterologous loading and extender modules | BIOTICA TECHNOLOGY LIMITED (GB) | 2005-11-01 | — | — | US | disclosed |
| US-20050089982-A1 | Polyketides and their synthesis | LEADLAY PETER F (GB) | 2005-04-28 | — | — | US | disclosed |
| US-6498161-B1 | TREATING INFECTION BY HIV; DELAYING OF THE ONSET OF AIDS; ASTHMA, ALLERGIC RHINITIS, DERMATITIS, CONJUNCTIVITIS, ATHEROSCLEROSIS OR RHEUMATOID ARTHRITIS | MERCK & CO., INC. | 2002-12-24 | — | — | US | disclosed |
| US-6399619-B1 | PREVENTION AND TREATMENT OF AIDS AND VIRAL INFECTION BY HIV | MERCK & CO., INC. | 2002-06-04 | — | — | US | disclosed |
| EP-1171122-A4 | PYRROLIDINE MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | MERCK & CO INC (US) | 2002-05-29 | — | — | EP | disclosed |
| EP-1171122-A1 | PYRROLIDINE MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | Merck & Co., Inc. (US) | 2002-01-16 | — | — | EP | disclosed |
| US-6248755-B1 | ANTIINFLAMMATORY AGENTS; ANTIALLERGENS; AUTOIMMUNE DISEASES | MERCK & CO., INC. | 2001-06-19 | — | — | US | disclosed |
| US-6159929-A | Optically active esters and their use as perfuming ingredients | FIRMENICH SA (CH) | 2000-12-12 | — | — | US | disclosed |
| WO-2000059502-A1 | PYRROLIDINE MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | MERCK & CO., INC. (US) | 2000-10-12 | — | — | WO | disclosed |
| WO-2000059498-A1 | PYRROLIDINE MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | MERCK & CO., INC. (US) | 2000-10-12 | — | — | WO | disclosed |
| WO-2000059497-A1 | PYRROLIDINE MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | MERCK & CO., INC. (US) | 2000-10-12 | — | — | WO | disclosed |
| EP-0910633-A2 | POLYKETIDES AND THEIR SYNTHESIS | Biotica Technology Limited (GB) | 1999-04-28 | — | — | EP | disclosed |
| WO-1998001546-A2 | POLYKETIDES AND THEIR SYNTHESIS | BIOTICA TECHNOLOGY LIMITED (GB) | 1998-01-15 | — | — | WO | disclosed |