Known targets — ChEMBL curated mechanism
ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
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 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 known ✓ | O43570 | 1/20 | 0.31 |
| ▸ | GMNN | O75496 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | THPO | P40225 | 1/20 | 0.43 |
| ▸ | HBB | P68871 | 1/20 | 0.43 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | BBOX1 | O75936 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | ENPEP | Q07075 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4404057 | 0.86 | BBOX1 (0.46) | GMNNALDH1A1LMNATP53TSHR | |
| SCHEMBL28570543 | 0.78 | GMNN (0.43) | GMNNALDH1A1LMNATP53TSHR | |
| SCHEMBL12403659 | 0.77 | ALDH1A1 (0.33) | ALDH1A1LMNATP53 | |
| SCHEMBL353864 | 0.76 | APP (0.41) | LMNASMN1; SMN2KDM4EEPHX2 | |
| SCHEMBL4414330 | 0.75 | GMNN (0.40) | GMNNALDH1A1LMNATP53TSHR | |
| SCHEMBL17272288 | 0.75 | BBOX1 (0.48) | GMNNALDH1A1LMNATP53TSHR | |
| SCHEMBL21690862 | 0.74 | — | — | |
| SCHEMBL4405325 | 0.72 | CA12 (0.35) | BBOX1KDM4EMAPTALOX15CA12 | |
| SCHEMBL353687 | 0.71 | APP (0.41) | LMNASMN1; SMN2KDM4EEPHX2 | |
| Lithium Ion SCHEMBL17272060 | 0.70 | BBOX1 (0.48) | GMNNALDH1A1LMNATP53TSHR |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115066445-A | Polyisocyanate formulations | 科思创德国股份有限公司 | 2022-09-16 | — | — | CN | disclosed |
| CN-112062935-B | Preparation method and application of odorless water-dispersible polyisocyanate | 广东也乐新材料制造有限公司 | 2022-02-11 | — | — | CN | disclosed |
| EP-1922389-B1 | ABSORBENT COMPOSITION CONTAINING MOLECULES WITH A HINDERED AMINE AND A METAL SULFONATE STRUCTURE FOR ACID GAS SCRUBBING PROCESS | EXXONMOBIL RES & ENG CO (US) | 2019-02-20 | — | — | EP | disclosed |
| US-20130243676-A1 | AMINE TREATING PROCESS FOR ACID GAS SEPARATION USING BLENDS OF AMINES AND ALKYLOXYAMINES | EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) | 2013-09-19 | — | — | US | disclosed |
| US-8480795-B2 | Absorbent composition containing molecules with a hindered amine and a metal sulfonate, phosphonate or carboxylate structure for acid gas scrubbing process | EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) | 2013-07-09 | — | — | US | disclosed |
| US-20090308248-A1 | Absorbent composition containing molecules with a hindered amine and a metal sulfonate, phosphonate or carboxylate structure for acid gas scrubbing process | SISKIN MICHAEL | 2009-12-17 | — | — | US | disclosed |
| EP-1922389-A1 | ABSORBENT COMPOSITION CONTAINING MOLECULES WITH A HINDERED AMINE AND A METAL SULFONATE, PHOSPHONATE OR CARBOXYLATE STRUCTURE FOR ACID GAS SCRUBBING PROCESS | EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) | 2008-05-21 | — | — | EP | disclosed |
| WO-2007021531-A1 | ABSORBENT COMPOSITION CONTAINING MOLECULES WITH A HINDERED AMINE AND A METAL SULFONATE, PHOSPHONATE OR CARBOXYLATE STRUCTURE FOR ACID GAS SCRUBBING PROCESS | EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) | 2007-02-22 | — | — | 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 (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-20090308248-A1 | Absorbent composition containing molecules with a hindered amine and a metal sulfonate, phosphonate or carboxylate structure for acid gas scrubbing process | CBS, MPST, TST | CA12 12/4885GMNN 160/4885ALDH1A1 1676/4885 |
“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.