⚠ 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 SCHEMBL8861489 | 0.98 | ALDH1A1 (0.47) | — | |
| SCHEMBL19718384 | 0.84 | — | — | |
| SCHEMBL11318891 | 0.84 | — | — | |
| SCHEMBL3861801 | 0.83 | — | — | |
| SCHEMBL15110978 | 0.78 | — | — | |
| SCHEMBL2593156 | 0.78 | — | — | |
| SCHEMBL1053330 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL7094518 | 0.77 | RAB9A (0.54) | — | |
| Hydrochloric Acid SCHEMBL10425982 | 0.77 | ALDH1A1 (0.43) | — | |
| SCHEMBL11366303 | 0.75 | SLC6A3 (0.47) | — |
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 40 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5700945-A | Process for preparing nizatidine | TORCAN CHEMICAL LTD. (CA) | 1997-12-23 | — | — | US | claimed |
| US-5541335-A | Process for preparing nizatidine | TORCAN CHEMICAL LTD. (CA) | 1996-07-30 | — | — | US | claimed |
| CN-102414168-B | Bridged spiro [2.4] heptane derivatives as ALX receptor and/or FPRL2 agonists | ACTELION PHARMACEUTICALS LTD | 2014-05-21 | — | — | CN | disclosed |
| CN-101903378-B | Aminotriazole derivatives | ACTELION PHARMACEUTICALS LTD | 2014-03-12 | — | — | CN | disclosed |
| US-8563714-B2 | Bridged spiro [2.4] heptane derivatives as ALX receptor and/or FPRL2 agonists | ACTELION PHARMACEUTICALS LTD. (CH) | 2013-10-22 | — | — | US | disclosed |
| EP-2135867-B1 | Trans-9, 10-dehydroepothilone C and trans-9, 10-dehydroepothilone D, analogs thereof and methods of making the same | KOSAN BIOSCIENCES INC (US) | 2013-09-25 | — | — | EP | disclosed |
| US-8536209-B2 | Aminotriazole derivatives as ALX agonists | ACTELION PHARMACEUTICALS LTD. (CH) | 2013-09-17 | — | — | US | disclosed |
| EP-2242743-B1 | AMINOPYRAZOLE DERIVATIVES | ACTELION PHARMACEUTICALS LTD (CH) | 2013-08-21 | — | — | EP | disclosed |
| EP-2432760-B1 | BRIDGED SPIRO [2.4] HEPTANE DERIVATIVES AS ALX RECEPTOR AND/OR FPRL2 AGONISTS | ACTELION PHARMACEUTICALS LTD (CH) | 2013-07-17 | — | — | EP | disclosed |
| CN-101903353-B | Aminopyrazole derivatives | ACTELION PHARMACEUTICALS LTD | 2013-04-10 | — | — | CN | disclosed |
| US-8288419-B2 | Aminopyrazole derivatives | ACTELION PHARMACEUTICALS, LTD (CH) | 2012-10-16 | — | — | US | disclosed |
| WO-2009077990-A1 | AMINOTRIAZOLE DERIVATIVES AS ALX AGONISTS | ACTELION PHARMACEUTICALS LTD (CH) | 2009-06-25 | — | — | WO | disclosed |
| CN-101088998-A | Trans-9,10-dehydroepothilone c and d, analogs thereof and methods of making the same | KOSAN BIOSCIENCES INC (US) | 2007-12-19 | — | — | CN | disclosed |
| CN-1330648-C | Trans-9, 10-dehydroepothilones C and D, analogs thereof and methods of making these compounds | KOSAN BIOSCIENCES INC (US) | 2007-08-08 | — | — | CN | disclosed |
| CN-1711259-A | Trans-9, 10-dehydroepothilones C and D, analogs thereof and methods of making these compounds | KOSAN BIOSCIENCES INC (US) | 2005-12-21 | — | — | CN | disclosed |
| EP-1562941-A2 | TRANS-9,10-DEHYDROEPOTHILONE C AND D, ANALOGS THEREOF AND METHOS OF MAKING THE SAME | Kosan Biosciences, Inc. (US) | 2005-08-17 | — | — | EP | disclosed |
| US-20040152708-A1 | Trans-9,10-dehydroepothilone C and D, analogs thereof and methods of making the same | KOSAN BIOSCIENCES, INC. | 2004-08-05 | — | — | US | disclosed |
| WO-2004043954-A2 | TRANS-9,10-DEHYDROEPOTHILONE C AND D, ANALOGS THEREOF AND METHOS OF MAKING THE SAME | KOSAN BIOSCIENCES INCORPORATED (US) | 2004-05-27 | — | — | WO | disclosed |
| US-5700945-A | Process for preparing nizatidine | TORCAN CHEMICAL LTD. (CA) | 1997-12-23 | — | — | US | disclosed |
| US-5541335-A | Process for preparing nizatidine | TORCAN CHEMICAL LTD. (CA) | 1996-07-30 | — | — | US | disclosed |