⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11894595 | 0.89 | RAD52 (0.30) | — | |
| SCHEMBL11894792 | 0.89 | — | — | |
| SCHEMBL27816251 | 0.88 | STAT3 (0.34) | — | |
| SCHEMBL7643752 | 0.86 | MPO (0.31) | — | |
| SCHEMBL499060 | 0.80 | GPR17 (0.31) | — | |
| SCHEMBL14867503 | 0.79 | STAT3 (0.32) | — | |
| SCHEMBL498445 | 0.79 | GPR17 (0.31) | — | |
| SCHEMBL10722190 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL3293373 | 0.79 | KDM4E (0.33) | — | |
| Hydrochloric Acid SCHEMBL3289312 | 0.78 | TBXAS1 (0.30) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8431117-B2 | Sickled erythrocytes with anti-tumor agents induce tumor vaso-occlusion and tumoricidal effects | TERMAN DAVID S (US) | 2013-04-30 | — | — | US | disclosed |
| US-20120195869-A1 | Sickled Erythrocytes with Anti-tumor Agents Induce Tumor Vaso-occlusion and Tumoricidal Effects | TERMAN DAVID S (US) | 2012-08-02 | — | — | US | disclosed |
| EP-0662972-B1 | 3-,8-SUBSTITUTED DEUTEROPORPHYRINE DERIVATIVES, PHARMACEUTICALS CONTAINING THEM AND METHODS OF PRODUCING THEM | DIAGNOSTIKFORSCHUNG INST (DE) | 2002-10-30 | — | — | EP | disclosed |
| US-5849259-A | 3-,8-substituted deuteroporphyrin derivatives, pharmaceutical agents containing the latter and process for their production | INSTITUT FUR DIAGNOSTIKFORSCHUNG GMBH (DE) | 1998-12-15 | — | — | US | disclosed |
| EP-0662972-A1 | 3-,8-SUBSTITUTED DEUTEROPORPHYRINE DERIVATIVES, PHARMACEUTICALS CONTAINING THEM AND METHODS OF PRODUCING THEM | INSTITUT FÜR DIAGNOSTIKFORSCHUNG GmbH AN DER FREIEN UNIVERSITÄT BERLIN (DE) | 1995-07-19 | — | — | EP | disclosed |
| WO-1994007894-A1 | 3-,8-SUBSTITUTED DEUTEROPORPHYRINE DERIVATIVES, PHARMACEUTICALS CONTAINING THEM AND METHODS OF PRODUCING THEM | INSTITUT FÜR DIAGNOSTIKFORSCHUNG GMBH (DE) | 1994-04-14 | — | — | WO | disclosed |