Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | HRH4 | Q9H3N8 | 3/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.31 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9085595 | 0.79 | ESR1 (0.38) | — | |
| SCHEMBL15356370 | 0.79 | HRH4 (0.51) | NPC1HRH4HRH3MEN1KMT2A | |
| SCHEMBL9277137 | 0.78 | CLK4 (0.35) | — | |
| SCHEMBL6696015 | 0.76 | NPC1 (0.40) | NPC1HRH4HRH3MEN1KMT2A | |
| SCHEMBL3814997 | 0.76 | ALDH1A1 (0.42) | NPC1MEN1KMT2AMKNK1 | |
| SCHEMBL9084848 | 0.74 | CDC7 (0.38) | — | |
| SCHEMBL602892 | 0.73 | MEN1 (0.41) | NPC1HRH4HRH3MEN1KMT2A | |
| SCHEMBL374260 | 0.70 | EGFR (0.53) | NPC1MEN1KMT2AFGFR4EGFR | |
| SCHEMBL18131074 | 0.70 | MEN1 (0.49) | NPC1MEN1KMT2AFGFR4EGFR | |
| SCHEMBL28158644 | 0.67 | DNM2 (0.45) | NPC1HRH4MEN1KMT2AEGFR |
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-5550240-A | Piperazinyl-bis(alkylamino)pyrimidine derivatives and process for preparing same | RICHTER GEDEON VEGYESZETI GYAR RT. (HU) | 1996-08-27 | — | — | US | disclosed |
| EP-0644882-A1 | NOVEL PIPERZINYL-BIS(ALKYLAMINO)PYRIMIDINE DERIVATIVES AND PROCESS FOR PREPARING SAME | RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) | 1995-03-29 | — | — | EP | disclosed |
| WO-1993025539-A1 | NOVEL PIPERZINYL-BIS(ALKYLAMINO)PYRIMIDINE DERIVATIVES AND PROCESS FOR PREPARING SAME | Richter Gedeon Vegyészeti Gyár Rt. (HU) | 1993-12-23 | — | — | WO | disclosed |