Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | CTSL | P07711 | 1/20 | 0.36 |
| ▸ | CTSB | P07858 | 1/20 | 0.36 |
| ▸ | GCK | P35557 | 1/20 | 0.36 |
| ▸ | MGLL | Q99685 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | TYR | P14679 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2334248 | 0.78 | GCK (0.56) | ALDH1A1NPC1KCNH2GCK | |
| SCHEMBL1329926 | 0.72 | NPC1 (0.44) | ALDH1A1NPC1KCNH2MAPTMEN1 | |
| SCHEMBL1327994 | 0.72 | GCK (0.54) | ALDH1A1NPC1KCNH2MAPTALOX12 | |
| SCHEMBL2317274 | 0.72 | MAPT (0.55) | ALDH1A1NPC1KCNH2MAPTMEN1 | |
| SCHEMBL9390463 | 0.68 | MAPT (0.58) | ALDH1A1NPC1MAPTALOX12LMNA | |
| SCHEMBL2337875 | 0.68 | MAPKAPK2 (0.40) | ALDH1A1KCNH2MEN1KMT2AGCK | |
| SCHEMBL14471918 | 0.67 | NPC1 (0.39) | ALDH1A1NPC1KCNH2MAPTMEN1 | |
| SCHEMBL6905303 | 0.66 | ALDH1A1 (0.71) | ALDH1A1NPC1MAPTMEN1KMT2A | |
| SCHEMBL6901408 | 0.65 | NPC1 (0.51) | ALDH1A1NPC1KCNH2MAPTMEN1 | |
| SCHEMBL17388766 | 0.64 | CCNE1 (0.51) | ALDH1A1NPC1MEN1KMT2ALMNA |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10647735-B2 | Metal complexes and methods of preparing the same | UNIVERSITY OF NEW BRUNSWICK (CA) | 2020-05-12 | — | — | US | disclosed |
| US-20200017535-A1 | METAL COMPLEXES AND METHODS OF PREPARING THE SAME | UNIVERSITY OF NEW BRUNSWICK (CA) | 2020-01-16 | — | — | US | disclosed |
| US-20040171652-A1 | Antiviral and spermicidal contraceptives; 2-thiourea pyridinyl derivative containing compositions | PARKER HUGHES INSTITUTE | 2004-09-02 | — | — | US | disclosed |
| US-6774139-B1 | CONTRACEPTIVES | PARKER HUGHES INSTITUTE | 2004-08-10 | — | — | US | disclosed |
| CN-1371367-A | Phenethyl-5-bromopyridylthiourea (PBT) and Dihydroalkoxybenzyloxopyrimidine (DABO) derivatives exhibiting spermicidal activity | PARKER HUGHES INST (US) | 2002-09-25 | — | — | CN | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-10647735-B2 | Metal complexes and methods of preparing the same | CACYBP, CLTB, VDAC2 | ALDH1A1 4328/4885NPC1 3355/4885KCNH2 167/4885 |
| US-20200017535-A1 | METAL COMPLEXES AND METHODS OF PREPARING THE SAME | CACYBP, CLTB, VDAC2 | ALDH1A1 4328/4885NPC1 3355/4885KCNH2 167/4885 |
| US-20040171652-A1 | Antiviral and spermicidal contraceptives; 2-thiourea pyridinyl derivative containing compositions | ZP1, NASP, SAMHD1 | ALDH1A1 1417/4885NPC1 4052/4885KCNH2 2772/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.