Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.44 |
| ▸ | DRD1 | P21728 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Isopropylbenzene SCHEMBL10951391 | 1.00 | SIGMAR1 (0.49) | SIGMAR1RAB9AALDH1A1L3MBTL1EPHX1 | |
| SCHEMBL27708207 | 0.96 | RAB9A (0.51) | SIGMAR1RAB9AALDH1A1L3MBTL1EPHX1 | |
| Isopropylbenzene SCHEMBL17318266 | 0.92 | SIGMAR1 (0.44) | SIGMAR1RAB9AALDH1A1L3MBTL1EPHX1 | |
| Isopropylbenzene SCHEMBL10601589 | 0.89 | MAOA (0.52) | SIGMAR1RAB9AALDH1A1L3MBTL1EPHX1 | |
| P-Cymene SCHEMBL21544791 | 0.88 | CNR2 (0.50) | SIGMAR1RAB9AALDH1A1L3MBTL1EPHX1 | |
| Butylbenzyl SCHEMBL8519397 | 0.88 | HTR2A (0.53) | SIGMAR1RAB9ANPC1SMN1; SMN2OPRM1 | |
| SCHEMBL21056162 | 0.84 | SIGMAR1 (0.53) | SIGMAR1ALDH1A1L3MBTL1SLC6A2SLC6A4 | |
| SCHEMBL597719 | 0.84 | IDO1 (0.50) | SIGMAR1ALDH1A1L3MBTL1KMT2A | |
| Isopropylbenzene SCHEMBL1451617 | 0.84 | TAAR1 (0.48) | HTR2A | |
| SCHEMBL40575 | 0.83 | — | — |
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 20 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5315049-A | Process for the nuclear chlorination of aromatic hydrocarbons | BAYER AKTIENGESELLSCHAFT (DE) | 1994-05-24 | — | — | US | claimed |
| CN-108530249-A | The method of benzene and isopropylbenzene production n-proplbenzene | 中国石油化工股份有限公司 | 2018-09-14 | — | — | CN | disclosed |
| CN-108530246-A | The method of benzene and production of propylene n-proplbenzene | 中国石油化工股份有限公司 | 2018-09-14 | — | — | CN | disclosed |
| CN-108530250-A | The method of benzene and diisopropylbenzene (DIPB) production n-proplbenzene | 中国石油化工股份有限公司 | 2018-09-14 | — | — | CN | disclosed |
| CN-108530245-A | The method of benzene and isopropyl alcohol production n-proplbenzene | 中国石油化工股份有限公司 | 2018-09-14 | — | — | CN | disclosed |
| CN-102464565-B | Method for producing isopropylbenzene by using benzene and propylene | CHINA PETROLEUM & CHEMICAL | 2014-08-13 | — | — | CN | disclosed |
| CN-102464566-B | Method for producing isopropylbenzene by using benzene and propylene | CHINA PETROLEUM & CHEMICAL | 2014-07-23 | — | — | CN | disclosed |
| CN-102464563-B | Method for producing isopropylbenzene | CHINA PETROLEUM & CHEMICAL | 2013-12-04 | — | — | CN | disclosed |
| EP-2408880-A2 | PROCESS FOR MAKING HIGH OCTANE GASOLINE WITH REDUCED BENZENE CONTENT BY BENZENE ALKYLATION AT HIGH BENZENE CONVERSION | ExxonMobil Research and Engineering Company (US) | 2012-01-25 | — | — | EP | disclosed |
| WO-2011076771-A1 | PROCESS FOR RECOVERING MONOALKYLBENZENE | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 2011-06-30 | — | — | WO | disclosed |
| WO-2011076952-A1 | PROCESS FOR RECOVERING MONOALKYLBENZENE | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 2011-06-30 | — | — | WO | disclosed |
| US-20110118522-A1 | OLEFIN FEED PURIFICATION PROCESS | EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) | 2011-05-19 | — | — | US | disclosed |
| WO-2011059878-A1 | OLEFIN FEED PURIFICATION PROCESS | EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) | 2011-05-19 | — | — | WO | disclosed |
| CN-1285548-C | Process for producing alkylbenzene | SINOPEC CORP (CN) | 2006-11-22 | — | — | CN | disclosed |
| CN-1772384-A | Prepn of phosphotungstic anion intercalated strontium aluminate hydrotalcite-solid acid alkylation catalyst | UNIV SOUTHEAST (CN) | 2006-05-17 | — | — | CN | disclosed |
| CN-1704392-A | Process for producing alkylbenzene | SINOPEC CORP (CN) | 2005-12-07 | — | — | CN | disclosed |
| CN-1031989-C | Process and catalyst compostion of alkylating benzene or substituted benzene or transalkylating alkylated benzene | DOW CHEMICAL CO (US) | 1996-06-12 | — | — | CN | disclosed |
| CN-1098028-A | Beta-zeolite molecular sieve catalyst and preparation method thereof | INST OF TIANJIN PETROCHEMICAL (CN) | 1995-02-01 | — | — | CN | disclosed |
| CN-1052655-A | The alkylation of benzene or substituted benzene or the transalkylation method of alkylated benzenes and catalyzer | DOW CHEMICAL CO (US) | 1991-07-03 | — | — | CN | disclosed |
| US-3962364-A | Alkylation in presence of phosphorus-modified crystalline luminosilicate catalyst | MOBIL OIL CORPORATION (US) | 1976-06-08 | — | — | US | disclosed |