Known targets — ChEMBL curated mechanism
MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of 1,2-Dichlorobenzene. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.62 |
| ▸ | LMNA | P02545 | 1/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | PNMT | P11086 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | NOS3 | P29474 | 2/20 | 0.41 |
| ▸ | NOS1 | P29475 | 2/20 | 0.41 |
| ▸ | NOS2 | P35228 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| 1,2-Dichlorobenzene SCHEMBL4065607 | 0.88 | TSHR (0.56) | TSHRLMNAALDH1A1CYP2A6CES2 | |
| 1,2-Dichlorobenzene SCHEMBL28151921 | 0.87 | TSHR (0.71) | TSHRLMNAALDH1A1CYP2A6PNMT | |
| 1,2-Dichlorobenzene SCHEMBL27583458 | 0.84 | TSHR (0.67) | TSHRLMNAALDH1A1CYP2A6PNMT | |
| 1,2-Dichlorobenzene SCHEMBL27492790 | 0.84 | TSHR (0.67) | TSHRLMNAALDH1A1CYP2A6CES2 | |
| 1,2-Dichlorobenzene SCHEMBL29182241 | 0.84 | TSHR (0.67) | TSHRLMNAALDH1A1CYP2A6CES2 | |
| 2-Chlorophenol SCHEMBL28504762 | 0.84 | ALDH1A1 (0.75) | TSHRLMNAALDH1A1CYP2A6HPGD | |
| 1,2-Dichlorobenzene SCHEMBL27497131 | 0.83 | TSHR (0.77) | TSHRLMNAALDH1A1CYP2A6CES2 | |
| Alcohol SCHEMBL28069650 | 0.82 | TSHR (0.52) | TSHRLMNAALDH1A1CYP2A6PNMT | |
| Alcohol SCHEMBL11612801 | 0.82 | TSHR (0.71) | TSHRLMNAALDH1A1PNMTNOS3 | |
| 1,2-Dichlorobenzene SCHEMBL27531928 | 0.81 | TSHR (0.62) | TSHRLMNAALDH1A1PNMTIDO1 |
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-101696179-A | Method for synthesizing and refining 2,4'-dihydroxy diphenyl sulfone | UNIV SHENYANG TECHNOLOGY | 2010-04-21 | — | — | CN | claimed |
| EP-3601216-B1 | SUBSTITUTED DIHYDROINDENE-4-CARBOXAMIDES AND ANALOGS THEREOF, AND METHODS USING SAME FOR THE TREATMENT OF HEPATITIS B VIRUS INFECTION | ARBUTUS BIOPHARMA CORP (CA) | 2023-10-25 | — | — | EP | disclosed |
| CN-105254623-A | SUBSTITUTED BENZAMIDES | HOFFMANN LA ROCHE | 2016-01-20 | — | — | CN | disclosed |
| CN-102731468-B | Derivative of aromatic propylene natural product and preparation method and application thereof | SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) | 2015-07-29 | — | — | CN | disclosed |
| CN-102951981-A | Asymmetric hydrogenation method for ketone compound | UNIV SHANGHAI JIAOTONG | 2013-03-06 | — | — | CN | disclosed |
| CN-102686563-A | Substituted benzamide derivatives | HOFFMANN LA ROCHE | 2012-09-19 | — | — | CN | disclosed |
| CN-101696179-A | Method for synthesizing and refining 2,4'-dihydroxy diphenyl sulfone | UNIV SHENYANG TECHNOLOGY | 2010-04-21 | — | — | CN | disclosed |
| CN-100522944-C | Carboxylic acid derivatives and salts thereof | EISAI CO LTD (JP) | 2009-08-05 | — | — | CN | disclosed |
| CN-1217918-C | Aminocyclohexyl ether compounds and uses thereof | NORTRAN PHARMACEUTICALS INC (CA) | 2005-09-07 | — | — | CN | disclosed |
| CN-1503774-A | Carboxylic acid derivatives and salts thereof | ������������ʽ���� | 2004-06-09 | — | — | CN | disclosed |
| CN-1134410-C | Amine derivatives, process for their preparation and their use as antiarrhythmic agents | �й�ʯ����������ʯ�ͻ����������ι� | 2004-01-14 | — | — | CN | disclosed |
| CN-1303364-A | Aminocyclohexyl ether compounds and uses thereof | NORTRAN PHARMACEUTICALS INC (CA) | 2001-07-11 | — | — | CN | disclosed |
| CN-1169141-A | Novel amine derivatives, process for their preparation and their use as antiarrhythmic agents | C & C RESEARCH LABS (KR) | 1997-12-31 | — | — | CN | disclosed |
| US-5565563-A | PIGMENTS FOR PLASTICS | SANDOZ LTD. (CH) | 1996-10-15 | — | — | US | disclosed |
| CN-1050198-A | New peptase and isomerase inhibitors | MERRELL DOW PHARMA (US) | 1991-03-27 | — | — | CN | disclosed |