⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11293593 | 0.83 | TSHR (0.41) | — | |
| SCHEMBL19287098 | 0.81 | TSHR (0.44) | — | |
| SCHEMBL17520244 | 0.81 | TSHR (0.44) | — | |
| SCHEMBL17520208 | 0.81 | TSHR (0.44) | — | |
| SCHEMBL1645888 | 0.80 | ALDH1A1 (0.32) | — | |
| SCHEMBL4372172 | 0.76 | ALDH1A1 (0.36) | — | |
| SCHEMBL3169952 | 0.76 | — | — | |
| SCHEMBL16363782 | 0.75 | TSHR (0.32) | — | |
| SCHEMBL12760667 | 0.74 | CYP3A4 (0.45) | — | |
| SCHEMBL9576683 | 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 20 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0373556-B1 | SANDALWOOD ODORANTS | BASF K & F Corporation (US) | 1993-09-01 | — | — | EP | claimed |
| US-5225608-A | Reacting acetoacetic ester with 4-methyl-4-methoxypentanal in presence of secondary amine, decarboxylating in presence of hydroxide, reducing to substituted cyclohexanol | BASF K & F CORPORATION (US) | 1993-07-06 | — | — | US | claimed |
| EP-0373556-A2 | Sandalwood odorants | BASF K & F Corporation (US) | 1990-06-20 | — | — | EP | claimed |
| EP-3303489-A1 | INK COMPOSITION, USE OF SAME, AND PRINTED PRODUCT | Giesecke+Devrient Currency Technology GmbH (DE) | 2018-04-11 | — | — | EP | disclosed |
| US-20170190697-A1 | NOVEL PYRROLIDINE COMPOUND AND APPLICATION AS MELANOCORTIN RECEPTOR AGONIST | MITSUBISHI TANABE PHARMA CORPORATION (JP) | 2017-07-06 | — | — | US | disclosed |
| EP-3150578-A1 | NOVEL PYRROLIDINE COMPOUND AND APPLICATION AS MELANOCORTIN RECEPTOR AGONIST | Mitsubishi Tanabe Pharma Corporation (JP) | 2017-04-05 | — | — | EP | disclosed |
| WO-2016188631-A1 | INK COMPOSITION, USE OF SAME, AND PRINTED PRODUCT | GIESECKE & DEVRIENT GMBH (DE) | 2016-12-01 | — | — | WO | disclosed |
| US-6969712-B2 | Benzimidazole derivatives | BANYU PHARMACEUTICAL CO., LTD. (JP) | 2005-11-29 | — | — | US | disclosed |
| US-20040044056-A1 | Benzimidazole derivatives | BANYU PHARMACEUTICAL CO., LTD. (JP) | 2004-03-04 | — | — | US | disclosed |
| EP-1342717-A1 | BENZIMIDAZOLE DERIVATIVES | BANYU PHARMACEUTICAL CO., LTD. (JP) | 2003-09-10 | — | — | EP | disclosed |
| US-5338633-A | Electrophotographic photoreceptor | MITSUBISHI KASEI CORPORATION (JP) | 1994-08-16 | — | — | US | disclosed |
| EP-0373556-B1 | SANDALWOOD ODORANTS | BASF K & F Corporation (US) | 1993-09-01 | — | — | EP | disclosed |
| US-5225608-A | Reacting acetoacetic ester with 4-methyl-4-methoxypentanal in presence of secondary amine, decarboxylating in presence of hydroxide, reducing to substituted cyclohexanol | BASF K & F CORPORATION (US) | 1993-07-06 | — | — | US | disclosed |
| US-5037802-A | Perfumes | BASF K & F CORPORATION (US) | 1991-08-06 | — | — | US | disclosed |
| US-4960946-A | SUBSTITUTED CYCLOHEXANONES; PERFUMES | BASF K&F (US) | 1990-10-02 | — | — | US | disclosed |
| EP-0373556-A2 | Sandalwood odorants | BASF K & F Corporation (US) | 1990-06-20 | — | — | EP | disclosed |
| US-4891447-A | ACYCLIC ETHER ALDEHYDE INTERMEDIATES | BASF K&F CORPORATION (US) | 1990-01-02 | — | — | US | disclosed |
| EP-0033465-B1 | METHOD FOR PRODUCING AN ARTICLE CONSISTING OF AN ELECTRICALLY CONDUCTIVE SUBSTRATE AND A COATING WITH A METALLIC APPEARANCE ADHERENTLY ARRANGED THEREON | BASF Lacke + Farben AG (DE) | 1983-09-21 | — | — | EP | disclosed |
| WO-1982003081-A1 | BATH SERVING FOR THE CATAPHORETIC STRATIFICATION OF SUBSTRATES SURFACES HAVING AN ELECTRIC CONDUCTIBILITY | ARLT KLAUS | 1982-09-16 | — | — | WO | disclosed |
| EP-0059468-A1 | Coating bath for cathodic electrodeposition on surfaces of electroconductive substrates | BASF Lacke + Farben AG (DE) | 1982-09-08 | — | — | EP | disclosed |