Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.38 |
| ▸ | DRD1 | P21728 | 1/20 | 0.38 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | CASR | P41180 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9404801 | 0.90 | SMN1; SMN2 (0.41) | SLC6A4LMNAMEN1KMT2AGAA | |
| SCHEMBL9404938 | 0.89 | CCNE2 (0.42) | CYP3A4CYP2D6LMNACYP2C19MEN1 | |
| SCHEMBL841941 | 0.73 | TAAR1 (0.34) | CYP2D6LMNASLC6A2ALOX15ALDH1A1 | |
| SCHEMBL6560129 | 0.71 | CYP3A4 (0.45) | SLC6A4CYP3A4CHRM2ADRA1ACYP2D6 | |
| SCHEMBL1783425 | 0.71 | CYP3A4 (0.45) | SLC6A4CYP3A4CHRM2ADRA1ACYP2D6 | |
| SCHEMBL6282747 | 0.70 | HDAC3 (0.36) | CYP3A4GAAALOX15ALDH1A1HTT | |
| SCHEMBL31307588 | 0.68 | KMT2A (0.39) | SLC6A4KMT2AL3MBTL1 | |
| Hydrochloric Acid SCHEMBL23928399 | 0.68 | HDAC3 (0.35) | CYP3A4GAAALOX15ALDH1A1L3MBTL1 | |
| SCHEMBL31307613 | 0.68 | MME (0.40) | ALDH1A1NPSR1ATMKDM4E | |
| SCHEMBL2622208 | 0.67 | CHRM2 (0.59) | SLC6A4CYP3A4CHRM2ADRA1ACYP2D6 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0400916-B1 | 4,5,6,11-Tetrahydrobenzo [6,7]-cycloocta[1,2-b]thiophen-6,11-imines and 6,11-dihydrobenzo[6,7]-cycloocta[1,2-b]thiophen-6,11 imines | PFIZER (US) | 1994-11-09 | — | — | EP | disclosed |
| US-5260309-A | 4,5,6,11-tetrahydrobenzo [6,7] cycloocta [1,2-b]thiophen-6,11-imines and 6,11-dihydrobenzo [6,7] cycloocta [1,2-b] thiophen-6,11-imines | PFIZER INC. (US) | 1993-11-09 | — | — | US | disclosed |
| WO-1990015060-A1 | 4,5,6,11-TETRAHYDROBENZO[6,7]CYCLOOCTA[1,2-b]THIOPHEN-6,11-IMINES AND 6,11-DIHYDROBENZO[6,7]CYCLOOCTA[1,2-b]THIOPHEN-6,11-IMINES | PFIZER INC. (US) | 1990-12-13 | — | — | WO | disclosed |
| EP-0400916-A2 | 4,5,6,11-Tetrahydrobenzo [6,7]-cycloocta[1,2-b]thiophen-6,11-imines and 6,11-dihydrobenzo[6,7]-cycloocta[1,2-b]thiophen-6,11 imines | PFIZER INC. (US) | 1990-12-05 | — | — | EP | disclosed |