⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6739490 | 0.75 | — | — | |
| SCHEMBL17375260 | 0.67 | — | — | |
| SCHEMBL17242539 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL2979655 | 0.67 | — | — | |
| SCHEMBL1894280 | 0.64 | — | — | |
| SCHEMBL7109 | 0.64 | — | — | |
| SCHEMBL20767778 | 0.61 | — | — | |
| SCHEMBL31122211 | 0.60 | ALDH1A1 (0.39) | — | |
| SCHEMBL596326 | 0.60 | — | — | |
| SCHEMBL16967 | 0.60 | — | — |
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 43 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20160311780-A1 | HETEROARYL COMPOUNDS AND USES THEREOF | CELGENE AVILOMICS RES INC (US) | 2016-10-27 | — | — | US | disclosed |
| US-20160279127-A1 | HETEROARYL COMPOUNDS AND USES THEREOF | CELGENE AVILOMICS RESEARCH, INC. | 2016-09-29 | — | — | US | disclosed |
| US-9393246-B2 | 4,6-disubstituted pyrimidines as kinase inhibitors | CELGENE AVILOMICS RESEARCH, INC. (US) | 2016-07-19 | — | — | US | disclosed |
| US-9296704-B2 | Substituted pyrimidines as protein kinase inhibitors | CELGENE AVILOMICS RESEARCH, INC. (US) | 2016-03-29 | — | — | US | disclosed |
| US-20150328223-A1 | HETEROARYL COMPOUNDS AND USES THEREOF | CELGENE AVILOMICS RESEARCH, INC. | 2015-11-19 | — | — | US | disclosed |
| US-9040541-B2 | 4,6-disubstituted pyrimidines useful as kinase inhibitors | CELGENE AVILOMICS RESEARCH, INC. (US) | 2015-05-26 | — | — | US | disclosed |
| US-20140303165-A1 | HETEROARYL COMPOUNDS AND USES THEREOF | CELGENE AVILOMICS RESEARCH, INC. | 2014-10-09 | — | — | US | disclosed |
| US-8748606-B2 | 4,6-diaminopyrimidines useful as kinase inhibitors | CELGENE AVILOMICS RESEARCH, INC. (US) | 2014-06-10 | — | — | US | disclosed |
| US-20130217688-A1 | HETEROARYL COMPOUNDS AND USES THEREOF | CELGENE AVILOMICS RESEARCH, INC. (US) | 2013-08-22 | — | — | US | disclosed |
| US-8445498-B2 | 4,6-disubstituted pyrimidines useful as kinase inhibitors | CELGENE AVILOMICS RESEARCH, INC. (US) | 2013-05-21 | — | — | US | disclosed |
| US-5484812-A | ADMINISTERING A RENIN INHIBITOR TO A SUBJECT | G.D. SEARLE & CO. (US) | 1996-01-16 | — | — | US | disclosed |
| US-5330996-A | Renin inhibitors | G. D. SEARLE & CO. (US) | 1994-07-19 | — | — | US | disclosed |
| US-5223535-A | Renin inhibitors | G. D. SEARLE & CO. (US) | 1993-06-29 | — | — | US | disclosed |
| WO-1993009108-A1 | AMINO ACYL AMINO PROPARGYL DIOL COMPOUNDS FOR TREATMENT OF HYPERTENSION | G.D. SEARLE & CO. (US) | 1993-05-13 | — | — | WO | disclosed |
| WO-1993009086-A1 | PROPARGYL GLYCINE AMINO PROPARGYL DIOL COMPOUNDS FOR TREATMENT OF HYPERTENSION | G.D. SEARLE & CO. (US) | 1993-05-13 | — | — | WO | disclosed |
| US-4188374-A | Attractant for the potato moth and the preparation of the former | Nederlandse Organisatie Voor Toegepast-Natuurwetenschappe-Lijk Onderzoek Ten Behoeve Van Nijverheid, Handel En-Verkeer (NL) | 1980-02-12 | — | — | US | disclosed |
| US-4014946-A | Synthesis of 1-bromonon-4-en-6-yne | ZOECON CORPORATION (US) | 1977-03-29 | — | — | US | disclosed |
| US-3994896-A | Sulfonate esters of non-4-en-6-yn-1-ol | ZOECON CORPORATION (US) | 1976-11-30 | — | — | US | disclosed |
| US-3985813-A | Unsaturated alcohols | ZOECON CORPORATION (US) | 1976-10-12 | — | — | US | disclosed |
| US-3954818-A | Synthesis of non-4-en-6-ynoic acid ester | ZOECON CORPORATION (US) | 1976-05-04 | — | — | US | disclosed |