⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15349877 | 0.67 | — | — | |
| Propiolic Acid SCHEMBL1077 | 0.67 | — | — | |
| Propiolic Acid SCHEMBL4192977 | 0.67 | CA1 (0.36) | — | |
| SCHEMBL28800054 | 0.67 | — | — | |
| SCHEMBL3001493 | 0.67 | — | — | |
| Propiolic Acid SCHEMBL11072332 | 0.64 | — | — | |
| Propiolic Acid SCHEMBL29283708 | 0.64 | — | — | |
| Propiolic Acid SCHEMBL9815678 | 0.64 | — | — | |
| Propiolic Acid SCHEMBL10945257 | 0.64 | — | — | |
| Propiolic Acid SCHEMBL28506299 | 0.64 | — | — |
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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0628534-B1 | Process for the stereospecific synthesis of leucotriene B4 having configuration 6Z, 8E, 10E and intermediate products | OREAL (FR) | 1997-10-29 | — | — | EP | claimed |
| US-5434281-A | Process for the stereospecific synthesis of leukotriene B4 in its 6Z, 8E, 10E configuration and intermediates | L'OREAL (FR) | 1995-07-18 | — | — | US | claimed |
| US-8133851-B2 | Heteroaroyl-substituted serine amides | BASF SE (DE) | 2012-03-13 | — | — | US | disclosed |
| US-20110318470-A1 | Method For Improving Plant Health | BASF SE (DE) | 2011-12-29 | — | — | US | disclosed |
| US-20110209253-A1 | Method for Improving Plant Health | BASF SE (DE) | 2011-08-25 | — | — | US | disclosed |
| US-7879761-B2 | Herbicides; 1-{Methylcarbamoyl-[(1-methyl-3-trifluoromethyl-1H-pyrazol-4-carbonyl)amino]methyl}-allyl acetate; acylation of keto compounds and reduction of the ketone, or the serine derivative is reacted with a heteroaryl acid and then with a secondary or tertiary amine | BASF AKTIENGESELLSCHAFT (DE) | 2011-02-01 | — | — | US | disclosed |
| US-7786046-B2 | Benzoyl-substituted serineamides | BASF AKTIENGESELLSCHAFT (DE) | 2010-08-31 | — | — | US | disclosed |
| US-20100099568-A1 | Heteroaroyl-Substituted Serine Amides | BASF SE (DE) | 2010-04-22 | — | — | US | disclosed |
| US-20090215628-A1 | Benzoyl-Substituted Alanines | BASF SE (DE) | 2009-08-27 | — | — | US | disclosed |
| US-20090186766-A1 | Heteroaroyl-Substituted Alanines with a Herbicidal Action | BASF SE (DE) | 2009-07-23 | — | — | US | disclosed |
| US-20090054240-A1 | Heteroaroyl-substituted Alanines | BASF SE (DE) | 2009-02-26 | — | — | US | disclosed |
| US-20090036311-A1 | Benzoyl-Substituted Alanines | BASF SE (DE) | 2009-02-05 | — | — | US | disclosed |
| US-20080200338-A1 | Heteroaroyl-Substituted Serineamides | BASF AKTIENGESELLSCHAFT (DE) | 2008-08-21 | — | — | US | disclosed |
| US-20080200542-A1 | Benzoyl-Substituted Serineamides | BASF AKTIENGESELLSCHAFT (DE) | 2008-08-21 | — | — | US | disclosed |
| US-5484812-A | ADMINISTERING A RENIN INHIBITOR TO A SUBJECT | G.D. SEARLE & CO. (US) | 1996-01-16 | — | — | US | disclosed |
| US-5434281-A | Process for the stereospecific synthesis of leukotriene B4 in its 6Z, 8E, 10E configuration and intermediates | L'OREAL (FR) | 1995-07-18 | — | — | US | disclosed |