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 | |
|---|---|---|---|---|
| SCHEMBL11094169 | 0.85 | IKBKB (0.41) | PTGS2EGFR | |
| SCHEMBL11087145 | 0.81 | EGFR (0.49) | EGFR | |
| SCHEMBL11091573 | 0.81 | CA1 (0.44) | PTGS2EGFR | |
| SCHEMBL1176530 | 0.79 | ALDH1A1 (0.58) | EGFR | |
| SCHEMBL11084251 | 0.78 | NPC1 (0.54) | EGFR | |
| SCHEMBL11092149 | 0.78 | AR (0.47) | PTGS2EGFR | |
| SCHEMBL12867865 | 0.78 | PRKDC (0.51) | EGFR | |
| SCHEMBL11092009 | 0.77 | NPC1 (0.50) | — | |
| SCHEMBL11812275 | 0.73 | ALDH1A1 (0.46) | PTGS2 | |
| SCHEMBL11805898 | 0.72 | ALDH1A1 (0.45) | PTGS2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4471129-A | ANTIHISTAMINES | LILLY INDUSTRIES LIMITED (GB) | 1984-09-11 | — | — | US | disclosed |
| US-4448787-A | ANTIALLERGENS | LILLY INDUSTRIES LIMITED (GB) | 1984-05-15 | — | — | US | disclosed |
| US-4304728-A | 2,6-DIHYDROXY-2,5-HEXADIENOIC ACID DERIVATIVES, ANTIHISTAMINE INTERMEDIATES | LILLY INDUSTRIES LIMITED (GB) | 1981-12-08 | — | — | US | disclosed |