⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11414328 | 0.80 | HTR1A (0.33) | — | |
| SCHEMBL26499779 | 0.76 | — | — | |
| SCHEMBL2124905 | 0.76 | — | — | |
| SCHEMBL1484450 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL27797668 | 0.74 | — | — | |
| SCHEMBL14384213 | 0.73 | SSTR4 (0.32) | — | |
| SCHEMBL2124945 | 0.71 | — | — | |
| SCHEMBL1620793 | 0.71 | — | — | |
| SCHEMBL22413765 | 0.71 | SLC6A2 (0.34) | — | |
| SCHEMBL2127211 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20070112008-A1 | Saframycins, analogues and uses thereof | MYERS ANDREW G | 2007-05-17 | — | — | US | disclosed |
| US-7122549-B2 | Saframycins, analogues and uses thereof | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2006-10-17 | — | — | US | disclosed |
| US-6809099-B2 | FOR THERAPY OF CANCER | PRESIDENT AND FELLOWS OF HARVARD COLLEGE | 2004-10-26 | — | — | US | disclosed |
| US-20040204419-A1 | Saframycins, analogues and uses thereof | MYERS ANDREW G (US) | 2004-10-14 | — | — | US | disclosed |
| EP-1339713-A2 | SAFRAMYCINS, ANALOGUES AND USES THEREOF | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2003-09-03 | — | — | EP | disclosed |
| US-20030008873-A1 | Saframycins, analogues and uses thereof | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2003-01-09 | — | — | US | disclosed |
| WO-2002040477-A2 | SAFRAMYCINS, ANALOGUES AND USES THEREOF | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2002-05-23 | — | — | WO | disclosed |