Predicted protein targets (top 2)
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| SCHEMBL10828701 | 1.00 | DHFR (0.53) | DHFRTYMS | |
| SCHEMBL10828966 | 0.90 | DHFR (0.59) | DHFRTYMS | |
| SCHEMBL10828968 | 0.90 | DHFR (0.59) | DHFRTYMS | |
| SCHEMBL10828741 | 0.89 | DHFR (0.50) | DHFRTYMS | |
| SCHEMBL10828695 | 0.89 | DHFR (0.59) | DHFRTYMS | |
| SCHEMBL10828745 | 0.89 | DHFR (0.50) | DHFRTYMS | |
| SCHEMBL10828694 | 0.89 | DHFR (0.59) | DHFRTYMS | |
| SCHEMBL14028320 | 0.88 | DHFR (0.57) | DHFRTYMS | |
| SCHEMBL10828954 | 0.88 | DHFR (0.48) | DHFRTYMS | |
| SCHEMBL10828952 | 0.88 | DHFR (0.48) | DHFRTYMS |
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 |
|---|---|---|---|---|---|---|---|
| US-4564616-A | Anti-cancer quinazoline derivatives | NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) | 1986-01-14 | — | — | US | disclosed |
| EP-0031237-B1 | QUINAZOLINE DERIVATIVES, PROCESSES FOR THEIR PREPARATION, COMPOSITIONS CONTAINING THEM AND THEIR USE AS ANTI-CANCER AGENTS | NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) | 1984-10-17 | — | — | EP | disclosed |
| US-4447608-A | ANTITUMOR AGENTS | NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) | 1984-05-08 | — | — | US | disclosed |
| EP-0031237-A1 | Quinazoline derivatives, processes for their preparation, compositions containing them and their use as anti-cancer agents | NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) | 1981-07-01 | — | — | EP | disclosed |