Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | BBOX1 | O75936 | 4/20 | 0.37 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL638497 | 0.86 | POLB (0.42) | POLBBBOX1BCHEACHERECQL | |
| SCHEMBL28396157 | 0.84 | BBOX1 (0.46) | POLBBBOX1BCHEACHERECQL | |
| Sulfuric Acid SCHEMBL7641807 | 0.83 | BBOX1 (0.42) | BBOX1 | |
| SCHEMBL31228538 | 0.83 | POLB (0.35) | POLBBBOX1BCHEACHERECQL | |
| SCHEMBL16594404 | 0.83 | BBOX1 (0.38) | POLBBBOX1BCHEACHERECQL | |
| SCHEMBL28321453 | 0.82 | DNM1 (0.41) | RECQLTSHRGLAHPGDMAPK1 | |
| SCHEMBL3204994 | 0.82 | POLB (0.36) | POLBBBOX1BCHEACHERECQL | |
| Tetrylammonium SCHEMBL5916499 | 0.81 | TSHR (0.44) | POLBBBOX1BCHEACHERECQL | |
| SCHEMBL14837040 | 0.81 | POLB (0.31) | POLBBBOX1 | |
| SCHEMBL5175331 | 0.81 | POLB (0.31) | POLB |
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 205 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106467456-B | Process for the preparation of symmetrical pincer ligands of the meta-terphenyl compound type | 赢创运营有限公司 | 2020-03-10 | — | — | CN | claimed |
| EP-2534281-B1 | METHOD FOR PRODUCING 4-ISOPROPYLCYCLOHEXYLMETHANOL | BASF SE (DE) | 2019-01-09 | — | — | EP | claimed |
| US-10131623-B2 | Process for preparing symmetric pincer ligands from the group of the M-terphenyl compounds | EVONIK DEGUSSA GMBH (DE) | 2018-11-20 | — | — | US | claimed |
| US-10131607-B2 | Process for preparing unsymmetric OCO pincer ligands from the group of the M-terphenyl compounds | EVONIK DEGUSSA GMBH (DE) | 2018-11-20 | — | — | US | claimed |
| EP-3133054-B1 | METHOD FOR THE PREPARATION OF SYMMETRICAL PINCER LIGANDS FROM THE GROUP OF M TERPHENYL COMPOUNDS | EVONIK DEGUSSA GMBH (DE) | 2018-03-07 | — | — | EP | claimed |
| EP-2411564-B1 | ELECTROCHEMICAL PROCESS FOR PRODUCING 3-TERT-BUTYLBENZALDEHYDE-DIMETHYLACETAL | BASF SE (DE) | 2017-05-10 | — | — | EP | claimed |
| US-20170050910-A1 | PROCESS FOR PREPARING UNSYMMETRIC OCO PINCER LIGANDS FROM THE GROUP OF THE M-TERPHENYL COMPOUNDS | EVONIK DEGUSSA GMBH (DE) | 2017-02-23 | — | — | US | claimed |
| US-20170050918-A1 | PROCESS FOR PREPARING SYMMETRIC PINCER LIGANDS FROM THE GROUP OF THE M-TERPHENYL COMPOUNDS | EVONIK DEGUSSA GMBH (DE) | 2017-02-23 | — | — | US | claimed |
| EP-3133189-A1 | METHOD FOR THE PREPARATION OF ASYMMETRIC OCO PINCER LIGANDS FROM THE GROUP OF M TERPHENYL COMPOUNDS | Evonik Degussa GmbH (DE) | 2017-02-22 | — | — | EP | claimed |
| EP-3133054-A1 | METHOD FOR THE PREPARATION OF SYMMETRICAL PINCER LIGANDS FROM THE GROUP OF M TERPHENYL COMPOUNDS | Evonik Degussa GmbH (DE) | 2017-02-22 | — | — | EP | claimed |
| EP-2411564-A1 | ELECTROCHEMICAL METHOD FOR PRODUCING 3 TERT.-BUTYL BENZALDEHYDE- DIMETHYLACETAL | BASF SE (DE) | 2012-02-01 | — | — | EP | claimed |
| US-20120016162-A1 | ELECTROCHEMICAL METHOD FOR PRODUCING 3-TERT-BUTYLBENZALDEHYDE DIMETHYL ACETAL | BASF SE (DE) | 2012-01-19 | — | — | US | claimed |
| US-20110207968-A1 | PROCESS FOR PREPARING 4-ISOPROPYLCYCLOHEXYLMETHANOL | BASF SE (DE) | 2011-08-25 | — | — | US | claimed |
| WO-2011098432-A2 | METHOD FOR PRODUCING 4-ISOPROPYLCYCLOHEXYLMETHANOL | BASF SE (DE) | 2011-08-18 | — | — | WO | claimed |
| WO-2010108874-A1 | ELECTROCHEMICAL METHOD FOR PRODUCING 3 TERT.-BUTYL BENZALDEHYDE- DIMETHYLACETAL | BASF SE (DE) | 2010-09-30 | — | — | WO | claimed |
| EP-1362022-B1 | METHOD FOR PRODUCING ORTHOCARBONIC ACID TRIALKYL ESTERS | BASF AG (DE) | 2007-11-28 | — | — | EP | claimed |
| US-7192512-B2 | Method for producing orthocarbonic acid trialkyl esters | BASF AKTIENGESELLSCHAFT (DE) | 2007-03-20 | — | — | US | claimed |
| EP-1362022-A1 | METHOD FOR PRODUCING ORTHOCARBONIC ACID TRIALKYL ESTERS | BASF AKTIENGESELLSCHAFT (DE) | 2003-11-19 | — | — | EP | claimed |
| US-20030183534-A1 | Method for producing orthocarbonic acid trialkyl esters | BASF AKTIENGESELLSCHAFT (DE) | 2003-10-02 | — | — | US | claimed |
| WO-2002020446-A1 | METHOD FOR PRODUCING ORTHOCARBONIC ACID TRIALKYL ESTERS | BASF AKTIENGESELLSCHAFT (DE) | 2002-03-14 | — | — | WO | claimed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (6 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-10131607-B2 | Process for preparing unsymmetric OCO pincer ligands from the group of the M-terphenyl compounds | COMT, MSMO1, TYR | ACHE 773/4885POLB 1156/4885BBOX1 1058/4885 |
| US-20170050910-A1 | PROCESS FOR PREPARING UNSYMMETRIC OCO PINCER LIGANDS FROM THE GROUP OF THE M-TERPHENYL COMPOUNDS | COMT, MSMO1, TYR | ACHE 773/4885POLB 1156/4885BBOX1 1058/4885 |
| US-10131623-B2 | Process for preparing symmetric pincer ligands from the group of the M-terphenyl compounds | C1R, C3AR1, M6PR | ACHE 666/4885POLB 3515/4885BBOX1 3632/4885 |
| US-20110207968-A1 | PROCESS FOR PREPARING 4-ISOPROPYLCYCLOHEXYLMETHANOL | CYP2E1, CYP3A4, DHPS | ACHE 399/4885POLB 1468/4885BBOX1 132/4885 |
| US-20120016162-A1 | ELECTROCHEMICAL METHOD FOR PRODUCING 3-TERT-BUTYLBENZALDEHYDE DIMETHYL ACETAL | TET3, TERT, ALKBH2 | ACHE 1051/4885POLB 473/4885BBOX1 99/4885 |
| US-20170050918-A1 | PROCESS FOR PREPARING SYMMETRIC PINCER LIGANDS FROM THE GROUP OF THE M-TERPHENYL COMPOUNDS | C1R, M6PR, C3AR1 | ACHE 641/4885POLB 3523/4885BBOX1 3542/4885 |
“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.