⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12955636 | 0.97 | ALDH1A1 (0.43) | — | |
| SCHEMBL6399307 | 0.97 | ALDH1A1 (0.43) | — | |
| SCHEMBL11359682 | 0.97 | ALDH1A1 (0.43) | — | |
| SCHEMBL24040789 | 0.97 | ALDH1A1 (0.43) | — | |
| Hydrochloric Acid SCHEMBL1929987 | 0.97 | — | — | |
| SCHEMBL23790917 | 0.97 | ALDH1A1 (0.43) | — | |
| SCHEMBL10563265 | 0.97 | — | — | |
| SCHEMBL6399313 | 0.97 | ALDH1A1 (0.43) | — | |
| SCHEMBL3615821 | 0.92 | — | — | |
| SCHEMBL132152 | 0.80 | — | — |
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 92 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0796839-B1 | Process for the preparation of a mixture of amino-methyl-cyclohexanes and diamino-methyl-cyclohexanes | BAYER AG (DE) | 2000-02-09 | — | — | EP | claimed |
| EP-0799817-B1 | Process for the preparation of a mixture of amino-methyl-cyclohexane and diamino-methyl-cyclohexane | BAYER AG (DE) | 1999-06-23 | — | — | EP | claimed |
| EP-0799817-A1 | Process for the preparation of a mixture of amino-methyl-cyclohexane and diamino-methyl-cyclohexane | BAYER AG (DE) | 1997-10-08 | — | — | EP | claimed |
| EP-0796839-A1 | Process for the preparation of a mixture of amino-methyl-cyclohexanes and diamino-methyl-cyclohexanes | BAYER AG (DE) | 1997-09-24 | — | — | EP | claimed |
| EP-0650471-A1 | ALICYCLIC DIAMINE FUNGICIDES | BTG INTERNATIONAL LIMITED (GB) | 1995-05-03 | — | — | EP | claimed |
| WO-1993024444-A1 | ALICYCLIC DIAMINE FUNGICIDES | BRITISH TECHNOLOGY GROUP LTD. (GB) | 1993-12-09 | — | — | WO | claimed |
| CN-1062144-A | The preparation method of benzodihydropyran carboxamide derivatives | DELAGRANGE LAB (FR) | 1992-06-24 | — | — | CN | claimed |
| EP-0231139-B1 | DIHYDROBENZOFURANE AND CHROMANE CARBOXAMIDE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS NEUROLEPTICS | Laboratoires DELAGRANGE (FR) | 1991-12-04 | — | — | EP | claimed |
| US-4436903-A | Process for the production of 7 β-substituted-3-unsubstituted-3-cephem-4-carboxylic acid compounds | CIBA-GEIGY CORPORATION (US) | 1984-03-13 | — | — | US | claimed |
| EP-0016725-B1 | PROCESS FOR THE PREPARATION OF 3-HYDROXYCEPHAM COMPOUNDS | CIBA-GEIGY AG (CH) | 1983-03-23 | — | — | EP | claimed |
| US-4301279-A | Process for the production of 3-hydroxy compounds | CIBA-GEIGY CORPORATION (US) | 1981-11-17 | — | — | US | claimed |
| US-4248868-A | FOR TREATING SYSTEMIC INFECTIONS BY GRAMPOSITIVE AND GRAM NEGATIVE BACTERIA | CIBA-GEIGY CORPORATION (US) | 1981-02-03 | — | — | US | claimed |
| EP-0016725-A1 | Process for the preparation of 3-hydroxycepham compounds | CIBA-GEIGY AG (CH) | 1980-10-01 | — | — | EP | claimed |
| US-4070477-A | PENICILLINS | CIBA-GEIGY CORPORATION (US) | 1978-01-24 | — | — | US | claimed |
| US-20230112832-A1 | Chemokine CXCR4 Receptor Modulators and Uses Related Thereto | UNIV EMORY (US) | 2023-04-13 | — | — | US | disclosed |
| CN-113881054-A | Polymeric flame retardant and preparation method and application thereof | 广东广山新材料股份有限公司 | 2022-01-04 | — | — | CN | disclosed |
| CN-107428700-B | 9-membered fused ring derivative | 盐野义制药株式会社 | 2021-08-03 | — | — | CN | disclosed |
| US-4017539-A | Biguanide compounds and anti-diabetic compositions | BOEHRINGER MANNHEIM G.M.B.H. (DT) | 1977-04-12 | — | — | US | disclosed |
| US-4001284-A | PRIMARY AMINES, 2,4-DIPHENOXY-5-SULFAMOYLBENZOIC ACID | HOECHST AKTIENGESELLSCHAFT (DT) | 1977-01-04 | — | — | US | disclosed |
| US-3947458-A | RHODIUM CATALYST, REACTING NITROGEN COMPOUND, OLEFIN, CARBON MONOXIDE, WATER | MONSANTO COMPANY (US) | 1976-03-30 | — | — | US | disclosed |