⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11625326 | 0.97 | SLC6A12 (0.41) | — | |
| SCHEMBL3759950 | 0.74 | LMNA (0.38) | — | |
| SCHEMBL9630383 | 0.72 | LMNA (0.46) | — | |
| SCHEMBL5921622 | 0.70 | SLC6A12 (0.38) | — | |
| SCHEMBL25362571 | 0.70 | — | — | |
| SCHEMBL26998899 | 0.70 | — | — | |
| SCHEMBL10807021 | 0.70 | — | — | |
| SCHEMBL25154605 | 0.69 | TSHR (0.37) | — | |
| SCHEMBL25154613 | 0.69 | TSHR (0.37) | — | |
| SCHEMBL21315847 | 0.69 | SLC6A1 (0.50) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3065757-A2 | AGONISTS OF GUANYLATE CYCLASE USEFUL FOR DOWNREGULATION OF PRO-INFLAMMATORY CYTOKINES | Synergy Pharmaceuticals Inc. (US) | 2016-09-14 | — | — | EP | disclosed |
| EP-2681236-A2 | PROCESS OF PREPARING GUANYLATE CYCLASE C AGONISTS | Synergy Pharmaceuticals Inc. (US) | 2014-01-08 | — | — | EP | disclosed |
| WO-2012118972-A2 | PROCESS OF PREPARING GUANYLATE CYCLASE C AGONISTS | SYNEGY PHARMACEUTICALS INC. (US) | 2012-09-07 | — | — | WO | disclosed |
| WO-2003051848-A2 | IMIDAZOLIDINEACETIC ACID DERIVATIVES | FERRING BV (NL) | 2003-06-26 | — | — | WO | disclosed |
| US-6303783-B1 | 1- (3-Heterocyclylphenyl) isothiourea, -isourea, -guanidine and -amidine herbicidal agents | AMERICAN CYANAMID CO. | 2001-10-16 | — | — | US | disclosed |
| US-5679704-A | FOR INHIBITING FORMATION OF ADVANCED GLYCOSYLATION END PRODUCTS OF PROTEINS | CASSELLA AKTIENGESELLSCHAFT (DE) | 1997-10-21 | — | — | US | disclosed |
| US-5500436-A | HYPOTENSIVE, CARDIOVASCULAR, OSTEOARTHRITIS | CASSELLA AKTIENGESELLSCHAFT (DE) | 1996-03-19 | — | — | US | disclosed |
| EP-0546867-A2 | Preparation of ethylenediaminetriacetic acid | HAMPSHIRE CHEMICAL CORP. (US) | 1993-06-16 | — | — | EP | disclosed |