Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 10/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 8/20 | 0.48 |
| ▸ | CYP1B1 | Q16678 | 5/20 | 0.48 |
| ▸ | CYP1A1 | P04798 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | AHR | P35869 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 2/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1127485 | 0.87 | TSHR (0.53) | TSHRCYP2D6CYP1A2MAPTATM | |
| SCHEMBL29137674 | 0.85 | TSHR (0.47) | TSHRCYP2D6CYP1A2NPC1RAB9A | |
| SCHEMBL1127202 | 0.85 | TSHR (0.47) | TSHRCYP2D6CYP1A2CYP1B1CYP1A1 | |
| SCHEMBL1126578 | 0.85 | TSHR (0.47) | TSHRCYP2D6CYP1A2CYP1B1LMNA | |
| SCHEMBL371069 | 0.83 | TSHR (0.54) | TSHRCYP2D6CYP1A2CYP1B1LMNA | |
| SCHEMBL9853987 | 0.82 | RAB9A (0.49) | TSHRCYP2D6MAPTATMMEN1 | |
| SCHEMBL302811 | 0.81 | — | — | |
| SCHEMBL10141202 | 0.81 | — | — | |
| SCHEMBL28298 | 0.81 | — | — | |
| SCHEMBL21114388 | 0.81 | TSHR (0.57) | TSHRCYP2D6CYP1A2MAPTRAB9A |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112358493-B | Micromolecular photothermal reagent based on boron-fluorine complex and preparation method and application thereof | 南京林业大学 | 2022-06-21 | — | — | CN | claimed |
| CN-102241672-A | 2,3-dipyrrolyl-6-acylaminoquinoxaline compounds and preparation method thereof | UNIVTAISHAN MEDICAL | 2011-11-16 | — | — | CN | disclosed |
| CN-101671289-B | Preparation method of 1, 2-di(2-pyrryl)-ethyldione | XUEMEI ZHAO | 2011-08-10 | — | — | CN | disclosed |
| CN-101671289-B | Preparation method of 1, 2-di(2-pyrryl)-ethyldione | XUEMEI ZHAO | 2011-08-10 | — | — | CN | disclosed |
| CN-101671289-A | Preparation method of 1, 2-di(2-pyrryl)-ethyldione | XUEMEI ZHAO | 2010-03-17 | — | — | CN | disclosed |
| CN-101671289-A | Preparation method of 1, 2-di(2-pyrryl)-ethyldione | XUEMEI ZHAO | 2010-03-17 | — | — | CN | disclosed |
| WO-2007121853-A2 | LIGHTENING AND/OR COLOURING AGENTS COMPRISING N,N'-OXALYLDIAZOLES AND/OR OXIMIDYLDIAZOLES | HENKEL AG & CO. KGAA (DE) | 2007-11-01 | — | — | WO | disclosed |
| US-20030162960-A1 | Colormetric sensor compositions and methods | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2003-08-28 | — | — | US | disclosed |
| US-6482949-B1 | Colormetric sensor compositions and methods | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2002-11-19 | — | — | US | disclosed |
| EP-0596876-A1 | CHELATOR COMPOSITIONS COMPRISING ALPHA-DIAMINE COMPOUNDS | THE PROCTER & GAMBLE COMPANY (US) | 1994-05-18 | — | — | EP | disclosed |
| EP-0596876-A4 | CHELATOR COMPOSITIONS COMPRISING ALPHA-DIAMINE COMPOUNDS. | PROCTER & GAMBLE (US) | 1993-03-01 | — | — | EP | disclosed |
| WO-1991016035-A1 | CHELATOR COMPOSITIONS COMPRISING ALPHA-DIAMINE COMPOUNDS | THE PROCTER & GAMBLE COMPANY (US) | 1991-10-31 | — | — | 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-20030162960-A1 | Colormetric sensor compositions and methods | PAH, NISCH, SPR | TSHR 1412/4885CYP2D6 1426/4885CYP1A2 1387/4885 |
“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.