⚠ 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 SCHEMBL29437904 | 0.97 | BBOX1 (0.33) | — | |
| Hydrochloric Acid SCHEMBL7289221 | 0.85 | BBOX1 (0.45) | — | |
| Bromide SCHEMBL31402695 | 0.85 | KDM4E (0.44) | — | |
| Hydrochloric Acid SCHEMBL31672182 | 0.83 | KDM4E (0.48) | — | |
| SCHEMBL3112898 | 0.81 | GNAI3 (0.35) | — | |
| SCHEMBL4902950 | 0.69 | KDM4E (0.35) | — | |
| SCHEMBL31452163 | 0.68 | BBOX1 (0.47) | — | |
| SCHEMBL4893881 | 0.67 | SLC18A3 (0.47) | — | |
| Hydrochloric Acid SCHEMBL31452211 | 0.66 | BBOX1 (0.48) | — | |
| SCHEMBL16667202 | 0.66 | LMNA (0.49) | — |
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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9382191-B2 | Stabilized compositions of volatile alkylating agents and methods of using thereof | ACTELION PHARMACEUTICALS, LTD. (CH) | 2016-07-05 | — | — | US | disclosed |
| US-8795659-B2 | Salts of isophosphoramide mustard and analogs thereof as anti-tumor agents | DEKK-TEC, INC. (US) | 2014-08-05 | — | — | US | disclosed |
| US-8795659-B2 | Salts of isophosphoramide mustard and analogs thereof as anti-tumor agents | DEKK-TEC, INC. (US) | 2014-08-05 | — | — | US | disclosed |
| US-20140194526-A1 | STABILIZED COMPOSITIONS OF VOLATILE ALKYLATING AGENTS AND METHODS OF USING THEREOF | ACTELION PHARMACEUTICALS LTD. (CH) | 2014-07-10 | — | — | US | disclosed |
| US-20140155491-A1 | Stabilized Compositions of Volatile Alkylating Agents and Methods of Using Thereof | ACTELION PHARMACEUTICALS, LTD. (CH) | 2014-06-05 | — | — | US | disclosed |
| US-20140142193-A1 | Stabilized Compositions Of Alkylating Agents And Methods Of Using Same | ACTELION PHARMACEUTICALS, LTD. (CH) | 2014-05-22 | — | — | US | disclosed |
| US-20140142193-A1 | Stabilized Compositions Of Alkylating Agents And Methods Of Using Same | ACTELION PHARMACEUTICALS, LTD. (CH) | 2014-05-22 | — | — | US | disclosed |
| US-8664278-B2 | Stabilized compositions of volatile alkylating agents and methods of using thereof | ACTELION PHARMACEUTICALS, LTD. (CH) | 2014-03-04 | — | — | US | disclosed |
| US-8664278-B2 | Stabilized compositions of volatile alkylating agents and methods of using thereof | ACTELION PHARMACEUTICALS, LTD. (CH) | 2014-03-04 | — | — | US | disclosed |
| US-20130310461-A1 | STABILIZED COMPOSITIONS OF VOLATILE ALKYLATING AGENTS AND METHODS OF USING THEREOF | CEPTARIS THERAPEUTICS, INC. (US) | 2013-11-21 | — | — | US | disclosed |
| US-20100152300-A1 | STABILIZED COMPOSITIONS OF ALKYLATING AGENTS AND METHODS OF USING SAME | HELSINN HEALTHCARE SA (CH) | 2010-06-17 | — | — | US | disclosed |
| US-7678778-B2 | Salts of isophosphoramide mustard and analogs thereof as anti-tumor agents | DEKK-TEC, INC. (US) | 2010-03-16 | — | — | US | disclosed |
| US-20100041767-A1 | treatment of cutaneous T-cell lymphoma by topically applying composition of a Nitrogen Mustard or a HX salt of the Nitrogen Mustard to the affected skin, wherein the Nitrogen Mustard or the HX salt of the Nitrogen Mustard is in a non-aqueous vehicle or carrier that does not include petrolatum or ethanol | YAUPON THERAPEUTICS, INC. (US) | 2010-02-18 | — | — | US | disclosed |
| US-20100029783-A9 | STABILIZED COMPOSITIONS OF ALKYLATING AGENTS AND METHODS OF USING SAME | HELSINN HEALTHCARE SA (CH) | 2010-02-04 | — | — | US | disclosed |
| WO-2009120493-A2 | STABILIZED COMPOSITIONS OF ALKYLATING AGENTS AND METHODS OF USING SAME | YAUPON THERAPEUTICS, INC (US) | 2009-10-01 | — | — | WO | disclosed |
| US-20090247645-A1 | STABILIZED COMPOSITIONS OF ALKYLATING AGENTS AND METHODS OF USING SAME | HELSINN BIREX PHARMACEUTICALS LIMITED (IE) | 2009-10-01 | — | — | US | disclosed |
| US-20080267945-A1 | Salts of Isophosphoramide Mustard and Analogs Thereof as Anti-Tumor Agents | DEKK-TEC, INC (US) | 2008-10-30 | — | — | US | disclosed |
| US-20080194699-A1 | topical nitrogen mustard or salts in nonaqueous vehicles or carriers, used for treating skin disorders | HELSINN HEALTHCARE SA (CH) | 2008-08-14 | — | — | US | disclosed |
| US-20080194699-A1 | topical nitrogen mustard or salts in nonaqueous vehicles or carriers, used for treating skin disorders | HELSINN HEALTHCARE SA (CH) | 2008-08-14 | — | — | US | disclosed |
| US-7293985-B2 | Methods for quenching pathogen inactivators in biological materials | CERUS CORPORATION (US) | 2007-11-13 | — | — | US | disclosed |