⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1297635 | 0.81 | — | — | |
| SCHEMBL11854728 | 0.81 | — | — | |
| SCHEMBL2963301 | 0.70 | — | — | |
| SCHEMBL25403 | 0.70 | — | — | |
| SCHEMBL1926176 | 0.70 | — | — | |
| SCHEMBL6434717 | 0.70 | — | — | |
| SCHEMBL8925736 | 0.68 | TSHR (0.33) | — | |
| SCHEMBL8925749 | 0.68 | TSHR (0.33) | — | |
| SCHEMBL8440196 | 0.67 | — | — | |
| SCHEMBL5215895 | 0.67 | — | — |
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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0959906-B1 | DELTA 1,6 BICYCLO [4,4,0] FUNCTIONAL DYES FOR CONTRAST ENHANCEMENT IN OPTICAL IMAGING | MALLINCKRODT INC (US) | 2003-09-17 | — | — | EP | disclosed |
| EP-0991428-B1 | DELTA1,2 BICYCLO 4,4,0] FUNCTIONAL DYES FOR CONTRAST ENHANCEMENT IN OPTICAL IMAGING | MALLINCKRODT INC (US) | 2003-07-30 | — | — | EP | disclosed |
| EP-0946203-B1 | TRICYCLIC FUNCTIONAL DYES FOR CONTRAST ENHANCEMENT IN OPTICAL IMAGING | MALLINCKRODT INC (US) | 2002-07-24 | — | — | EP | disclosed |
| EP-0991428-A4 | DELTA1,2 BICYCLO 4,4,0] FUNCTIONAL DYES FOR CONTRAST ENHANCEMENT IN OPTICAL IMAGING | MALLINCKRODT INC (US) | 2000-04-12 | — | — | EP | disclosed |
| EP-0991428-A1 | DELTA1,2 BICYCLO 4,4,0] FUNCTIONAL DYES FOR CONTRAST ENHANCEMENT IN OPTICAL IMAGING | MALLINCKRODT INC. (US) | 2000-04-12 | — | — | EP | disclosed |
| EP-0946203-A4 | TRICYCLIC FUNCTIONAL DYES FOR CONTRAST ENHANCEMENT IN OPTICAL IMAGING | MALLINCKRODT INC (US) | 2000-03-29 | — | — | EP | disclosed |
| EP-0959906-A4 | — | — | 1999-12-22 | — | — | EP | disclosed |
| EP-0959906-A1 | DELTA 1,6 BICYCLO [4,4,0] FUNCTIONAL DYES FOR CONTRAST ENHANCEMENT IN OPTICAL IMAGING | Mallinckrodt Inc. (US) | 1999-12-01 | — | — | EP | disclosed |
| EP-0946203-A1 | TRICYCLIC FUNCTIONAL DYES FOR CONTRAST ENHANCEMENT IN OPTICAL IMAGING | MALLINCKRODT, INC. (US) | 1999-10-06 | — | — | EP | disclosed |
| US-5858329-A | MRI diagnostic procedures using tripodal pyridinyl metal complexes | HOECHST CELANESE CORPORATION (US) | 1999-01-12 | — | — | US | disclosed |
| EP-0711180-A4 | FUNCTIONALIZED TRIPODAL LIGANDS FOR IMAGING APPLICATIONS | MALLINCKRODT MEDICAL INC (US) | 1996-11-27 | — | — | EP | disclosed |
| EP-0739337-A1 | FUNCTIONALIZED MACROCYCLIC LIGANDS FOR IMAGING APPLICATIONS | MALLINCKRODT MEDICAL, INC. (US) | 1996-10-30 | — | — | EP | disclosed |
| US-5565184-A | Functionalized tripodal ligands for x-ray & radioactive imaging applications | MALLINCKRODT MEDICAL, INC. (US) | 1996-10-15 | — | — | US | disclosed |
| US-5554749-A | Functionalized macrocyclic ligands for imaging applications | MALLINCKRODT MEDICAL, INC. | 1996-09-10 | — | — | US | disclosed |
| EP-0711180-A1 | FUNCTIONALIZED TRIPODAL LIGANDS FOR IMAGING APPLICATIONS | MALLINCKRODT MEDICAL, INC. (US) | 1996-05-15 | — | — | EP | disclosed |
| WO-1995032004-A1 | FUNCTIONALIZED BICYCLO[2.2.1] HEPTANE AND [2.2.2] OCTANE SYSTEM AS PREORGANIZED LIGANDS FOR IMAGING APPLICATIONS | MALLINCKRODT MEDICAL, INC. (US) | 1995-11-30 | — | — | WO | disclosed |
| WO-1995019185-A1 | FUNCTIONALIZED AZA-MACROBICYCLIC LIGANDS FOR IMAGING APPLICATIONS | MALLINCKRODT MEDICAL, INC. (US) | 1995-07-20 | — | — | WO | disclosed |
| US-5417959-A | Functionalized aza-crytand ligands for diagnostic imaging applications | MALLINCKRODT MEDICAL, INC. (US) | 1995-05-23 | — | — | US | disclosed |
| US-5405601-A | Functionalized tripodal ligands for imaging applications | MALLINCKRODT MEDICAL INC. (US) | 1995-04-11 | — | — | US | disclosed |
| WO-1995001124-A1 | FUNCTIONALIZED TRIPODAL LIGANDS FOR IMAGING APPLICATIONS | MALLINCKRODT MEDICAL, INC. (US) | 1995-01-12 | — | — | WO | disclosed |