⚠ 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL8582620 | 0.80 | HRH4 (0.77) | — | |
| SCHEMBL9193111 | 0.80 | CYP1A2 (0.71) | — | |
| SCHEMBL9197363 | 0.76 | — | — | |
| SCHEMBL9191747 | 0.76 | — | — | |
| SCHEMBL6562227 | 0.74 | — | — | |
| Bromide SCHEMBL4434174 | 0.74 | CYP1A2 (0.95) | — | |
| SCHEMBL9195962 | 0.74 | — | — | |
| Bromide SCHEMBL17747992 | 0.74 | HRH4 (1.00) | — | |
| SCHEMBL14005136 | 0.72 | CYP1A2 (0.58) | — | |
| Bromide SCHEMBL4732426 | 0.72 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1112254-B1 | CYANINE DYES AND SYNTHESIS METHODS THEREOF | NEN LIFE SCIENCE PROD INC (US) | 2013-02-27 | — | — | EP | disclosed |
| EP-1112254-A4 | CYANINE DYES AND SYNTHESIS METHODS THEREOF | NEN LIFE SCIENCE PROD INC (US) | 2005-03-16 | — | — | EP | disclosed |
| US-6437141-B2 | FOR LABELING TARGET MOLECULES | NEN LIFE SCIENCE PRODUCTS, INC. | 2002-08-20 | — | — | US | disclosed |
| US-20010020098-A1 | For labeling target molecules | NEN LIFE SCIENCE PRODUCTS, INC. | 2001-09-06 | — | — | US | disclosed |
| EP-1112254-A2 | CYANINE DYES AND SYNTHESIS METHODS THEREOF | NEN Life Science Products, Inc. (US) | 2001-07-04 | — | — | EP | disclosed |
| US-6224644-B1 | CYANINE DYES INCLUDES FREE OR PROTECTED THIOL, AMINE OR HYDROXY SUBSTITUENT CAPABLE OF REACTING WITH A TARGET MOLECULE THROUGH A NEUCLOPHILIC DISPLACEMENT, USEFUL IN LABELING A VARIETY OF TARGET MOLECULES | NEN LIFE SCIENCE PRODUCTS, INC. | 2001-05-01 | — | — | US | disclosed |
| US-6204389-B1 | DEBLOCKING; NUCLEOPHILIC DISPLACEMENT | NEN LIFE SCIENCE PRODUCTS, INC. | 2001-03-20 | — | — | US | disclosed |
| US-6197956-B1 | FLUORESCENT BENZIMIDAZOLE, BENZOTHIAZOLE, BENZOXAZOLE, BENZOTHIAZINE, BENZOXAZINE AND QUINOLINE DYES | NEN LIFE SCIENCE PRODUCTS, INC. | 2001-03-06 | — | — | US | disclosed |
| WO-2000063296-A2 | CYANINE DYES AND SYNTHESIS METHODS THEREOF | NEN LIFE SCIENCE PRODUCTS, INC. (US) | 2000-10-26 | — | — | WO | disclosed |
| US-6114350-A | Cyanine dyes and synthesis methods thereof | NEN LIFE SCIENCE PRODUCTS, INC. (US) | 2000-09-05 | — | — | US | disclosed |