⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7624154 | 0.74 | ALDH1A1 (0.48) | — | |
| SCHEMBL247141 | 0.62 | — | — | |
| SCHEMBL1062398 | 0.57 | — | — | |
| SCHEMBL7624094 | 0.57 | GABRR1 (0.32) | — | |
| SCHEMBL29572751 | 0.56 | IDH1 (0.30) | — | |
| SCHEMBL12138872 | 0.56 | — | — | |
| SCHEMBL11154028 | 0.55 | — | — | |
| SCHEMBL12262030 | 0.54 | — | — | |
| Hypoxanthine SCHEMBL7037918 | 0.51 | ALDH1A1 (1.00) | — | |
| SCHEMBL127925 | 0.51 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1218337-B1 | SYNTHESIS OF 3,5,7|-1H-IMIDAZO 1,5-A|IMIDAZOL-2(3H)-ONE COMPOUNDS | TORREY PINES INST (US) | 2007-10-31 | — | — | EP | disclosed |
| US-6664282-B2 | For preparing and using libraries of compounds as well as individual compounds of the libraries; for screening compounds for combinatorial chemistry | TORREY PINES INSTITUTE FOR MOLECULAR STUDIES | 2003-12-16 | — | — | US | disclosed |
| US-6545032-B1 | Combinatorial libraries | TORREY PINES INSTITUTE FOR MOLECULAR STUDIES | 2003-04-08 | — | — | US | disclosed |
| US-20020193608-A1 | Synthesis of [3,5,7]--1H-imidazo [1,5-a]imidazol-2 (3H)- one compounds | ELABDELLAOUI HASSAN M (US) | 2002-12-19 | — | — | US | disclosed |
| EP-1218337-A4 | SYNTHESIS OF 3,5,7]-1H-IMIDAZO 1,5-A]IMIDAZOL-2(3H)-ONE COMPOUNDS | TORREY PINES INST (US) | 2002-09-11 | — | — | EP | disclosed |
| EP-1218337-A1 | SYNTHESIS OF 3,5,7]-1H-IMIDAZO 1,5-A]IMIDAZOL-2(3H)-ONE COMPOUNDS | TORREY PINES INSTITUTE FOR MOLECULAR STUDIES (US) | 2002-07-03 | — | — | EP | disclosed |
| WO-2001019783-A1 | SYNTHESIS OF [3,5,7]-1H-IMIDAZO[1,5-A]IMIDAZOL-2(3H)-ONE COMPOUNDS | TORREY PINES INSTITUTE FOR MOLECULAR STUDIES (US) | 2001-03-22 | — | — | WO | disclosed |