⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2361759 | 0.87 | TSHR (0.50) | — | |
| SCHEMBL26300316 | 0.86 | RECQL (0.43) | — | |
| SCHEMBL6821739 | 0.84 | RECQL (0.42) | — | |
| SCHEMBL6817873 | 0.82 | TDP1 (0.43) | — | |
| Hydrochloric Acid SCHEMBL15855934 | 0.82 | TSHR (0.46) | — | |
| SCHEMBL1396293 | 0.81 | — | — | |
| SCHEMBL73416 | 0.81 | TSHR (0.56) | — | |
| SCHEMBL8740891 | 0.81 | TSHR (0.40) | — | |
| SCHEMBL10667342 | 0.80 | TSHR (0.57) | — | |
| SCHEMBL5680390 | 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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2534138-B1 | 1,2,3-TRIAZOLE-BASED PEPTIDOMIMETIC INTEGRIN INHIBITORS FOR THE DIAGNOSIS AND THERAPY OF TUMORS | UNIVERSITA' DEGLI STUDI DI FIRENZE (IT) | 2017-01-25 | — | — | EP | disclosed |
| US-9301908-B2 | Detergent composition | P & PF CO., LTD. (JP) | 2016-04-05 | — | — | US | disclosed |
| CN-105294701-A | Cyclic P1 linkers as factor XIA inhibitors | BRISTOL MYERS SQUIBB CO | 2016-02-03 | — | — | CN | disclosed |
| CN-103702999-B | Cyclic P1 linkers as factor XIA inhibitors | BRISTOL-MYERS SQUIBB CO. (US) | 2015-11-25 | — | — | CN | disclosed |
| US-9073954-B2 | 5-substituted benzimidazolium compounds | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2015-07-07 | — | — | US | disclosed |
| US-20150112051-A1 | CONSTRUCTION OF CELL PENETRATING NUCLEIC ACIDS | Panzner, Steffen | 2015-04-23 | — | — | US | disclosed |
| US-20150112051-A1 | CONSTRUCTION OF CELL PENETRATING NUCLEIC ACIDS | Panzner, Steffen | 2015-04-23 | — | — | US | disclosed |
| US-8957191-B2 | Nucleic acid comprising zwitterionic nucleotides | STEFFEN PANZNER (DE) | 2015-02-17 | — | — | US | disclosed |
| US-8957191-B2 | Nucleic acid comprising zwitterionic nucleotides | STEFFEN PANZNER (DE) | 2015-02-17 | — | — | US | disclosed |
| US-8809338-B2 | 1,2,3-triazole-based peptidomimetic integrin inhibitors for the diagnosis and therapy of tumors | UNIVERSITA' DEGLI STUDI DI FIRENZE (IT) | 2014-08-19 | — | — | US | disclosed |
| CN-103702999-A | Cyclic p1 linkers as factor xia inhibitors | BRISTOL MYERS SQUIBB CO | 2014-04-02 | — | — | CN | disclosed |
| US-20130040964-A1 | 1,2,3-TRIAZOLE-BASED PEPTIDOMIMETIC INTEGRIN INHIBITORS FOR THE DIAGNOSIS AND THERAPY OF TUMORS | UNIVERSITA' DEGLI STUDI DI FIRENZE (IT) | 2013-02-14 | — | — | US | disclosed |
| US-20110137019-A1 | NUCLEIC ACID COMPRISING ZWITTERIONIC NUCLEOTIDES | BIONTECH PROTEIN THERAPEUTICS GMBH (DE) | 2011-06-09 | — | — | US | disclosed |
| US-20110137019-A1 | NUCLEIC ACID COMPRISING ZWITTERIONIC NUCLEOTIDES | BIONTECH PROTEIN THERAPEUTICS GMBH (DE) | 2011-06-09 | — | — | US | disclosed |
| US-20100029529-A1 | Surfactant having chlorine-capturing ability and anti-discoloration ability and chemical formulation containing the same surfactant | KIKUCHI RYUJI | 2010-02-04 | — | — | US | disclosed |
| EP-2143726-A1 | Nucleic acid comprising zwitterionic nucleotides | Novosom AG (DE) | 2010-01-13 | — | — | EP | disclosed |
| US-20070265181-A1 | Surfactant having chlorine-capturing ability and anti-discoloration ability and chemical formulation containing the same surfactant | KAWAKEN FINE CHEMICALS CO., LTD. (JP) | 2007-11-15 | — | — | US | disclosed |
| US-20070195309-A1 | PHOTOCHROMIC PROBES | WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 2007-08-23 | — | — | US | disclosed |
| EP-0701432-A1 | AQUEOUS SURFACTANT COMPOSITIONS | Henkel Kommanditgesellschaft auf Aktien (DE) | 1996-03-20 | — | — | EP | disclosed |
| WO-1994027570-A1 | AQUEOUS SURFACTANT COMPOSITIONS | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 1994-12-08 | — | — | WO | disclosed |