Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.47 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.47 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.47 |
| ▸ | ESR1 | P03372 | 2/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL18719647 | 0.86 | ESR1 (0.44) | HDAC8HDAC6ADRA2AADRA2BADRA2C | |
| SCHEMBL8164326 | 0.86 | HDAC8 (0.44) | HDAC8HDAC6ADRA2AADRA2BADRA2C | |
| SCHEMBL3857347 | 0.86 | HDAC8 (0.44) | HDAC8HDAC6ADRA2AADRA2BADRA2C | |
| SCHEMBL20036515 | 0.83 | NR1I2 (0.50) | HDAC8HDAC6ADRA2AADRA2BADRA2C | |
| SCHEMBL13210867 | 0.83 | HDAC8 (0.42) | HDAC8HDAC6ADRA2AADRA2BADRA2C | |
| SCHEMBL27642755 | 0.83 | HDAC8 (0.38) | HDAC8HDAC6ADRA2AADRA2BADRA2C | |
| SCHEMBL19524889 | 0.83 | TRPA1 (0.38) | HDAC8HDAC6ADRA2AADRA2BADRA2C | |
| SCHEMBL18896172 | 0.83 | NR1I2 (0.50) | HDAC8HDAC6ADRA2AADRA2BADRA2C | |
| SCHEMBL18801388 | 0.81 | NR1I2 (0.57) | HDAC8HDAC6ADRA2AADRA2BADRA2C | |
| SCHEMBL19901495 | 0.80 | ESR1 (0.47) | ESR1ESR2CYP2A6HTR2ACYP1A2 |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106928253-A | A kind of preparation method of pinoxaden | 武汉工程大学 | 2017-07-07 | — | — | CN | claimed |
| CN-111362833-B | Double anthracene D-delta-A type deep blue organic fluorescent material and preparation method and application thereof | 陕西师范大学 | 2023-04-25 | — | — | CN | disclosed |
| WO-2021061823-A1 | CHEMICAL COMPOUNDS | Boragen, Inc. (US) | 2021-04-01 | — | — | WO | disclosed |
| WO-2021061823-A1 | CHEMICAL COMPOUNDS | Boragen, Inc. (US) | 2021-04-01 | — | — | WO | disclosed |
| CN-111362833-A | Dianthracene D-delta-A type deep blue organic fluorescent material and preparation method and application thereof | 陕西师范大学 | 2020-07-03 | — | — | CN | disclosed |
| CN-110627831-A | Bibiaryl acetal phosphines, their preparation and use in coupling reactions | 东莞市均成高新材料有限公司 | 2019-12-31 | — | — | CN | disclosed |
| US-20190343826-A1 | TETRAHYDRO- AND DIHYDRO-ISOQUINOLINE PRMT5 INHIBITORS AND USES THEREOF | Epizyme, Inc. | 2019-11-14 | — | — | US | disclosed |
| EP-3209296-B1 | ETHYL N-BOC PIPERIDINYL PYRAZOLO PYRIDONES AS JANUS KINASE INHIBITORS | MERCK SHARP & DOHME (US) | 2019-07-10 | — | — | EP | disclosed |
| CN-109912457-A | A kind of preparation method of 2,6- diethyl -4- aminomethyl phenyl malononitrile | 浙江中山化工集团股份有限公司 | 2019-06-21 | — | — | CN | disclosed |
| CN-109336762-A | The synthetic method of 2- (2,6- diethyl -4- methylbenzene) diethyl malonate | 江苏富鼎化学有限公司 | 2019-02-15 | — | — | CN | disclosed |
| US-9833421-B2 | Method for synthesizing (E)-anethol and related compounds by cross coupling reaction of potassium allyltrifluroborate and 4-bromoanisole and aryl halides | TENNESSEE BOARD OF REGENTS (US) | 2017-12-05 | — | — | US | disclosed |
| EP-2520570-A1 | AMINOPYRIDINE COMPOUND | Ube Industries, Ltd. (JP) | 2012-11-07 | — | — | EP | disclosed |
| US-20120259123-A1 | AMINOPYRIDINE COMPOUND | UBE INDUSTRIES, LTD. (JP) | 2012-10-11 | — | — | US | disclosed |
| CN-102666490-A | Aminopyridine compound | UBE INDUSTRIES | 2012-09-12 | — | — | CN | disclosed |
| WO-2008033455-A2 | BIPHENYL AND HETEROARYL PHENYL DERIVATIVES AS PROTEIN TYROSINE PHOSPHATASES INHIBITORS | THE INSTITUTES FOR PHARMACEUTICAL DISCOVERY, LLC (US) | 2008-03-20 | — | — | 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 (2 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-20190343826-A1 | TETRAHYDRO- AND DIHYDRO-ISOQUINOLINE PRMT5 INHIBITORS AND USES THEREOF | PRMT5, PRMT1, PRMT3 | HDAC8 320/4885HDAC6 177/4885ADRA2A 3967/4885 |
| US-20120259123-A1 | AMINOPYRIDINE COMPOUND | PTGIS, QDPR, PTGIR | HDAC8 3651/4885HDAC6 2572/4885ADRA2A 266/4885 |
“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.