Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.47 |
| ▸ | MITF | O75030 | 1/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | GABRP | O00591 | 1/20 | 0.46 |
| ▸ | GABRD | O14764 | 1/20 | 0.46 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.46 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.46 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.46 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.46 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.46 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.46 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.46 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.46 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.46 |
| ▸ | GABRE | P78334 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL11007812 | 0.86 | GABRP (0.52) | ALDH1A1HTTNPSR1MITFHSP90AA1 | |
| SCHEMBL11084165 | 0.82 | ALDH1A1 (0.47) | ALDH1A1HTTNPSR1MITFHSP90AA1 | |
| SCHEMBL27513043 | 0.80 | GABRP (0.55) | ALDH1A1HTTNPSR1MITFHSP90AA1 | |
| SCHEMBL10998695 | 0.79 | TDP1 (0.55) | ALDH1A1HTTNPSR1MITFHSP90AA1 | |
| SCHEMBL13316485 | 0.79 | CYP3A4 (0.54) | ALDH1A1HTTNPSR1MITFHSP90AA1 | |
| SCHEMBL11078643 | 0.79 | ALDH1A1 (0.49) | ALDH1A1HTTNPSR1MITFHSP90AA1 | |
| SCHEMBL2991425 | 0.78 | PTGDR2 (0.51) | ALDH1A1HTTNPSR1MITFHSP90AA1 | |
| SCHEMBL11037117 | 0.75 | MAPT (0.50) | ALDH1A1HTTNPSR1MITFHSP90AA1 | |
| SCHEMBL28157462 | 0.74 | NR4A1 (0.61) | ALDH1A1HTTNPSR1MITFHSP90AA1 | |
| SCHEMBL11076174 | 0.74 | CYP2C8 (0.50) | ALDH1A1HTTNPSR1MITFHSP90AA1 |
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-2061795-B1 | PYRROLO[2,1-C][1,4]BENZODIAZEPINE HYBRIDS AND A PROCESS FOR THE PREPARATION THEREOF | COUNCIL SCIENT IND RES (IN) | 2014-01-15 | — | — | EP | disclosed |
| EP-2061795-A2 | PYRROLO[2,1-C][1,4]BENZODIAZEPINE HYBRIDS AND A PROCESS FOR THE PREPARATION THEREOF | Council Of Scientific&industrial Research (IN) | 2009-05-27 | — | — | EP | disclosed |
| US-7528128-B2 | Pyrrolo[2,1-C][1,4]benzodiazepine hybrids and a process for the preparation thereof | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2009-05-05 | — | — | US | disclosed |
| US-20080064870-A1 | Pyrrolo[2,1-C][1,4]benzodiazepine hybrids and a process for the preparation thereof | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2008-03-13 | — | — | US | disclosed |
| WO-2008020455-A2 | PYRROLO[2,1-C][1,4]BENZODIAZEPINE HYBRIDS AND A PROCESS FOR THE PREPARATION THEREOF | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2008-02-21 | — | — | 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-20080064870-A1 | Pyrrolo[2,1-C][1,4]benzodiazepine hybrids and a process for the preparation thereof | CYP11B1, CYP11B2, GABRA5 | ALDH1A1 1083/4885HTT 3952/4885NPSR1 198/4885 |
“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.