Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NUDT1 | P36639 | 1/20 | 0.44 |
| ▸ | BACE1 | P56817 | 1/20 | 0.43 |
| ▸ | EGFR | P00533 | 3/20 | 0.40 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 2/20 | 0.39 |
| ▸ | ACHE | P22303 | 2/20 | 0.39 |
| ▸ | GRM5 | P41594 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | MERTK | Q12866 | 3/20 | 0.37 |
| ▸ | APP | P05067 | 1/20 | 0.37 |
| ▸ | CSNK2A1 | P68400 | 2/20 | 0.36 |
| ▸ | TRIM58 | Q8NG06 | 1/20 | 0.36 |
| ▸ | IGF1R | P08069 | 1/20 | 0.36 |
| ▸ | MAP4K4 | O95819 | 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 | |
|---|---|---|---|---|
| SCHEMBL25450067 | 0.76 | KMT2A (0.45) | BACE1NPC1MAPTPKMRAB9A | |
| SCHEMBL30216045 | 0.76 | KMT2A (0.45) | BACE1NPC1MAPTPKMRAB9A | |
| SCHEMBL16277295 | 0.73 | BACE1 (0.47) | BACE1EGFRGRM5KMT2ASMN1; SMN2 | |
| SCHEMBL31047329 | 0.73 | BACE1 (0.47) | BACE1EGFRGRM5KMT2ASMN1; SMN2 | |
| SCHEMBL16755315 | 0.73 | BACE1 (0.56) | NUDT1BACE1ACHEGRM5RAB9A | |
| SCHEMBL31082814 | 0.72 | BACE1 (0.43) | BACE1EGFRGRM5SMN1; SMN2KCNH2 | |
| SCHEMBL31083305 | 0.72 | BACE1 (0.43) | BACE1GRM5MAPTKMT2ASMN1; SMN2 | |
| SCHEMBL2264548 | 0.72 | NCF1 (0.50) | NUDT1EGFRBCHEACHEGRM5 | |
| SCHEMBL30824524 | 0.72 | NCF1 (0.50) | NUDT1EGFRBCHEACHEGRM5 | |
| SCHEMBL5581805 | 0.68 | NQO2 (0.43) | EGFRLRRK2NPC1KMT2AMERTK |
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 |
|---|---|---|---|---|---|---|---|
| CN-103664787-B | Alkynes heteroaromatic ring compounds and application thereof | NANJING SANHOME PHARMACEUTICAL CO., LTD. (CN) | 2015-09-09 | — | — | CN | disclosed |
| EP-2896620-A1 | ALKYNYL HETEROAROMATIC RING COMPOUND AND APPLICATION THEREOF | Nanjing Sanhome Pharmaceutical Co., Ltd. (CN) | 2015-07-22 | — | — | EP | disclosed |
| US-20150152088-A1 | ALKYNYL HETEROAROMATIC COMPOUND AND USE THEREOF | NANJING SANHOME PHARMACEUTICAL CO., LTD. (CN) | 2015-06-04 | — | — | US | 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 (1 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-20150152088-A1 | ALKYNYL HETEROAROMATIC COMPOUND AND USE THEREOF | ALK, CYP3A43, ALKBH3 | NUDT1 81/4885BACE1 420/4885EGFR 738/4885 |
“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.