Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.54 |
| ▸ | HTR2A | P28223 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.45 |
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 2/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4059254 | 0.91 | TAAR1 (0.58) | TAAR1HTR2AMAOADRD2DRD3 | |
| SCHEMBL9855401 | 0.84 | TAAR1 (0.65) | TAAR1DRD2DRD3SLC6A3SLC6A2 | |
| SCHEMBL10521145 | 0.81 | TAAR1 (0.62) | TAAR1DRD2DRD3SLC6A3SLC6A2 | |
| Thiophene SCHEMBL23646785 | 0.79 | HTR2A (0.54) | HTR2ASIGMAR1MAOAMAOBSLC6A3 | |
| SCHEMBL8671494 | 0.78 | TAAR1 (0.71) | TAAR1DRD2DRD3SLC6A3SLC6A2 | |
| SCHEMBL54347 | 0.78 | HTR2A (0.70) | TAAR1HTR2ASIGMAR1MAOAMAOB | |
| Benzene SCHEMBL26105945 | 0.78 | DRD2 (0.53) | TAAR1HTR2ADRD2DRD3SLC6A3 | |
| SCHEMBL2089546 | 0.77 | CALM1 (0.57) | TAAR1SIGMAR1DRD2DRD3SLC6A3 | |
| SCHEMBL2090609 | 0.76 | — | — | |
| SCHEMBL19824769 | 0.76 | — | — |
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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-4149178-A | — | — | None | — | — | JP | disclosed |
| CN-109790079-B | C (sp) of organozinc reagents and heterocyclic (pseudo) halides3)-C(sp2) Cross-coupling reaction | 香港科技大学 | 2022-06-03 | — | — | CN | disclosed |
| CN-109790079-A | C (the sp of organic zinc reagent and heterocycle (quasi-) halide3)-C(sp2) cross-coupling reaction | 香港科技大学 | 2019-05-21 | — | — | CN | disclosed |
| WO-2018019291-A1 | C(SP3)-C(SP2) CROSS-COUPLING REACTION OF ORGANOZINC REAGENTS AND HETEROCYCLIC (PSEUDO)HALIDES | THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) | 2018-02-01 | — | — | WO | disclosed |
| US-9018397-B2 | Pyrrolopyrrole derivatives, their manufacture and use | BASF SE (DE) | 2015-04-28 | — | — | US | disclosed |
| US-9018397-B2 | Pyrrolopyrrole derivatives, their manufacture and use | BASF SE (DE) | 2015-04-28 | — | — | US | disclosed |
| CN-101889016-B | Pyrrolopyrrole derivatives, their manufacture and use | BASF SE | 2014-02-12 | — | — | CN | disclosed |
| EP-2209788-B1 | PYRROLOPYRROLE DERIVATIVES, THEIR MANUFACTURE AND USE | BASF SE (DE) | 2013-09-04 | — | — | EP | disclosed |
| US-20130172575-A1 | Pyrrolopyrrole derivatives, their manufacture and use | BASF SE (DE) | 2013-07-04 | — | — | US | disclosed |
| US-20130172575-A1 | Pyrrolopyrrole derivatives, their manufacture and use | BASF SE (DE) | 2013-07-04 | — | — | US | disclosed |
| US-8404864-B2 | Pyrrolopyrrole derivatives, their manufacture and use | BASF SE (DE) | 2013-03-26 | — | — | US | disclosed |
| US-8404864-B2 | Pyrrolopyrrole derivatives, their manufacture and use | BASF SE (DE) | 2013-03-26 | — | — | US | disclosed |
| US-20110004004-A1 | PYRROLOPYRROLE DERIVATIVES, THEIR MANUFACTURE AND USE | BASF SE (DE) | 2011-01-06 | — | — | US | disclosed |
| US-20110004004-A1 | PYRROLOPYRROLE DERIVATIVES, THEIR MANUFACTURE AND USE | BASF SE (DE) | 2011-01-06 | — | — | US | disclosed |
| CN-101889016-A | Pyrrolopyrrole derivatives, its preparation and purposes | BASF SE | 2010-11-17 | — | — | CN | disclosed |
| JP-H04149178-A | THIOPHENE DERIVATIVE AND ITS PRODUCTION | AGENCY OF IND SCIENCE & TECHNOL | 1992-05-22 | — | — | JP | 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-20110004004-A1 | PYRROLOPYRROLE DERIVATIVES, THEIR MANUFACTURE AND USE | PPOX, PIN1, DDT | TAAR1 3996/4885HTR2A 4116/4885RAB9A 1372/4885 |
“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.