⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19647675 | 1.00 | — | — | |
| SCHEMBL28705496 | 0.78 | MGAM (0.42) | — | |
| SCHEMBL28243 | 0.78 | TSHR (0.50) | — | |
| SCHEMBL8398556 | 0.78 | — | — | |
| SCHEMBL29128888 | 0.78 | CYP2C19 (0.34) | — | |
| SCHEMBL5576930 | 0.78 | TSHR (0.50) | — | |
| SCHEMBL55045 | 0.76 | — | — | |
| SCHEMBL53570 | 0.76 | — | — | |
| SCHEMBL18232032 | 0.76 | — | — | |
| SCHEMBL99435 | 0.76 | TSHR (0.48) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009071524-A2 | INDOLINONE DERIVATIVES AND PROCESS FOR THEIR MANUFACTURE | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-06-11 | — | — | WO | disclosed |
| WO-2009071523-A1 | PROCESS FOR THE MANUFACTURE OF AN INDOLINONE DERIVATIVE | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-06-11 | — | — | WO | disclosed |
| US-7528219-B2 | Method for incorporating nitrogen containing methine light absorbers in PET and compositions thereof | EASTMAN CHEMICAL COMPANY (US) | 2009-05-05 | — | — | US | disclosed |
| US-20080045629-A1 | METHOD FOR INCORPORATING NITROGEN CONTAINING METHINE LIGHT ABSORBERS IN PET AND COMPOSITIONS THEREOF | EASTMAN CHEMICAL COMPANY (US) | 2008-02-21 | — | — | US | disclosed |