⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14997834 | 0.84 | TSHR (0.38) | — | |
| SCHEMBL10991978 | 0.76 | TSHR (0.44) | — | |
| SCHEMBL10052028 | 0.75 | — | — | |
| SCHEMBL3104310 | 0.75 | — | — | |
| SCHEMBL14514232 | 0.75 | — | — | |
| SCHEMBL9753461 | 0.75 | — | — | |
| SCHEMBL10522453 | 0.74 | TSHR (0.34) | — | |
| SCHEMBL527689 | 0.74 | — | — | |
| SCHEMBL11662820 | 0.74 | TSHR (0.40) | — | |
| SCHEMBL27176987 | 0.74 | — | — |
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 49 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104418798-B | A kind of method of the picoline of 2 chlorine of continuous production 5 | 江苏扬农化工集团有限公司 | 2017-07-21 | — | — | CN | claimed |
| CN-106699646-A | Synthetic method of acetamiprid | 江苏长青生物科技有限公司 | 2017-05-24 | — | — | CN | claimed |
| CN-107746386-A | A kind of production method of the PMC of 2 chlorine 5 | 庆阳凯威尔能源化工有限公司 | 2018-03-02 | — | — | CN | disclosed |
| CN-104418798-B | A kind of method of the picoline of 2 chlorine of continuous production 5 | 江苏扬农化工集团有限公司 | 2017-07-21 | — | — | CN | disclosed |
| US-20160115120-A1 | METHOD FOR THE CONTROLLED HYDROFORMYLATION AND ISOMERIZATION OF A NITRILE/ESTER/OMEGA UNSATURATED FATTY ACID | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) | 2016-04-28 | — | — | US | disclosed |
| CN-104418798-A | Method for continuous production of 2-chloro-5-methylpyridine | JIANGSU YANGNONG CHEMICAL GROUP CO LTD | 2015-03-18 | — | — | CN | disclosed |
| US-8754100-B2 | Nitrogen-containing fused heterocyclic compounds and their use as beta amyloid production inhibitors | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2014-06-17 | — | — | US | disclosed |
| US-7919523-B2 | Inhibitors of aspartyl protease | VERTEX PHARMACEUTICALS, INC. (US) | 2011-04-05 | — | — | US | disclosed |
| US-7919523-B2 | Inhibitors of aspartyl protease | VERTEX PHARMACEUTICALS, INC. (US) | 2011-04-05 | — | — | US | disclosed |
| US-7919523-B2 | Inhibitors of aspartyl protease | VERTEX PHARMACEUTICALS, INC. (US) | 2011-04-05 | — | — | US | disclosed |
| US-20090042973-A1 | Inhibitors of aspartyl protease | VERTEX PHARMACEUTICALS INCORPORATED | 2009-02-12 | — | — | US | disclosed |
| EP-0915839-B1 | MANUFACTURING PROCESS FOR 6-AMINOCAPRONITRILE | BASF AG (DE) | 2001-09-19 | — | — | EP | disclosed |
| WO-2001021567-A2 | HYDROFORMYLATION PROCESS UTILIZING MULTIDENTATE PHOSPHITE LIGANDS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2001-03-29 | — | — | WO | disclosed |
| WO-2000056451-A1 | CATALYST COMPRISING A METAL COMPLEX OF THE VIII SUBGROUP BASED ON A PHOSPHINE AMIDITE LIGAND AND ITS UTILIZATION FOR HYDROFORMYLATION AND HYDROCYANATION | BASF AKTIENGESELLSCHAFT (DE) | 2000-09-28 | — | — | WO | disclosed |
| WO-2000047551-A2 | INHIBITORS OF ASPARTYL PROTEASE | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2000-08-17 | — | — | WO | disclosed |
| US-6048997-A | CARBONYLATION AND HYDROGENATION, DECARBONYLATION TO FORM HYDROFORMYLATION AND REMOVAL OF 5-FORMYLVALERONITRILE, HYDROGENATION AND ISOLATION 6-AMINOCAPRONITRILE | BASF AKTIENGESELLSCHAFT (DE) | 2000-04-11 | — | — | US | disclosed |
| CN-1221402-A | Process for preparing 6-aminocapronitrile | BASF AG (DE) | 1999-06-30 | — | — | CN | disclosed |
| EP-0915839-A1 | MANUFACTURING PROCESS FOR 6-AMINOCAPRONITRILE | BASF AKTIENGESELLSCHAFT (DE) | 1999-05-19 | — | — | EP | disclosed |
| WO-1998005632-A1 | MANUFACTURING PROCESS FOR 6-AMINOCAPRONITRILE | BASF AKTIENGESELLSCHAFT (DE) | 1998-02-12 | — | — | WO | disclosed |
| US-4102913-A | CYANOALKYLATION, ALKALI METAL HYDROXIDE, ACRYLONITRILE | RUHRCHEMIE AKTIENGESELLSCHAFT (DE) | 1978-07-25 | — | — | US | disclosed |