Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | ATM | Q13315 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.46 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.45 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.45 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | PTPRC | P08575 | 1/20 | 0.40 |
| ▸ | S100A4 | P26447 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL741714 | 0.83 | NPC1 (0.62) | NPC1RAB9AATMTDP1ALDH1A1 | |
| SCHEMBL11694301 | 0.83 | NPC1 (0.62) | NPC1RAB9AATMTDP1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL10444520 | 0.82 | NPC1 (0.61) | NPC1RAB9AATMTDP1ALDH1A1 | |
| Bromide SCHEMBL5144105 | 0.82 | NPC1 (0.61) | NPC1RAB9AATMTDP1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL599994 | 0.82 | NPC1 (0.65) | NPC1RAB9AATMTDP1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL30343291 | 0.82 | NPC1 (0.65) | NPC1RAB9AATMTDP1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL6131224 | 0.82 | NPC1 (0.65) | NPC1RAB9AATMTDP1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL31173710 | 0.82 | NPC1 (0.65) | NPC1RAB9AATMTDP1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL5158699 | 0.79 | NPC1 (0.62) | NPC1RAB9AATMTDP1ALDH1A1 | |
| Thiocyanic Acid SCHEMBL6501837 | 0.79 | NPC1 (0.54) | NPC1RAB9AATMTDP1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4139402-A1 | STERICALLY SHIELDED HEPTAMETHINE CYANINE DYES | University of Notre Dame du Lac (US) | 2023-03-01 | — | — | EP | claimed |
| WO-2021216183-A1 | STERICALLY SHIELDED HEPTAMETHINE CYANINE DYES | UNIVERSITY OF NOTRE DAME DU LAC (US) | 2021-10-28 | — | — | WO | claimed |
| US-20230219933-A1 | STERICALLY SHIELDED HEPTAMETHINE CYANINE DYES | UNIVERSITY OF NOTRE DAME DU LAC (US) | 2023-07-13 | — | — | US | disclosed |
| EP-4139402-A1 | STERICALLY SHIELDED HEPTAMETHINE CYANINE DYES | University of Notre Dame du Lac (US) | 2023-03-01 | — | — | EP | disclosed |
| WO-2021216183-A1 | STERICALLY SHIELDED HEPTAMETHINE CYANINE DYES | UNIVERSITY OF NOTRE DAME DU LAC (US) | 2021-10-28 | — | — | WO | 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-20230219933-A1 | STERICALLY SHIELDED HEPTAMETHINE CYANINE DYES | FCGR3B, MYADM, FCGR2A | NPC1 3942/4885RAB9A 2690/4885ATM 3799/4885 |
“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.