⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9825082 | 0.93 | TSHR (0.52) | — | |
| SCHEMBL7572266 | 0.86 | — | — | |
| SCHEMBL12162154 | 0.79 | — | — | |
| SCHEMBL1463502 | 0.75 | — | — | |
| SCHEMBL5871854 | 0.74 | TSHR (0.61) | — | |
| SCHEMBL27278875 | 0.74 | — | — | |
| SCHEMBL195396 | 0.74 | — | — | |
| SCHEMBL9568602 | 0.74 | TSHR (0.41) | — | |
| SCHEMBL19291645 | 0.74 | TSHR (0.58) | — | |
| SCHEMBL27669959 | 0.73 | — | — |
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-2090575-A1 | Processes and intermediates for the preparation of N4-phenyl-quinazoline-4-amine derivatives | Array Biopharma, Inc. (US) | 2009-08-19 | — | — | EP | disclosed |
| CN-1123558-C | Method for preparing polyalohols | BASF AG (DE) | 2003-10-08 | — | — | CN | disclosed |
| EP-0946483-B1 | METHOD FOR PRODUCING POLYALCOHOLS | BASF AG (DE) | 2002-09-04 | — | — | EP | disclosed |
| US-6187971-B1 | MULTISTAGE REACTION OF ALDEHYDE WITH FORMALDEHYDE, DISTILLATION AND CATALYTIC REACTION TO CONVERT THE ALDEHYDE TO UNSATURATED COMPOUND | BASF AKTIENGESELLSCHAFT (DE) | 2001-02-13 | — | — | US | disclosed |
| CN-1238753-A | Method for preparing polyalohols | BASF AG (DE) | 1999-12-15 | — | — | CN | disclosed |
| EP-0946483-A1 | METHOD FOR PRODUCING POLYALCOHOLS | BASF AKTIENGESELLSCHAFT (DE) | 1999-10-06 | — | — | EP | disclosed |
| WO-1998028253-A1 | METHOD FOR PRODUCING POLYALCOHOLS | BASF AKTIENGESELLSCHAFT (DE) | 1998-07-02 | — | — | WO | disclosed |