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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 known ✓ | P00918 | 2/20 | 0.46 |
| ▸ | CA4 known ✓ | P22748 | 2/20 | 0.46 |
| ▸ | CA12 known ✓ | O43570 | 1/20 | 0.43 |
| ▸ | CA1 known ✓ | P00915 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 2/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | CES1 | P23141 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.50 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.50 |
| ▸ | FEN1 | P39748 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL1516246 | 0.80 | MAPK1 (0.58) | RECQLMAPK1MAPTTDP1CYP3A4 | |
| SCHEMBL10424359 | 0.80 | HSD11B1 (0.62) | RECQLMAPK1MAPTTDP1CYP3A4 | |
| SCHEMBL137832 | 0.78 | MAPK1 (0.56) | RECQLMAPK1MAPTTDP1CYP3A4 | |
| SCHEMBL9488123 | 0.78 | MAOA (0.42) | RECQLMAPK1MAPTTDP1CYP3A4 | |
| SCHEMBL2188285 | 0.77 | MAPT (0.54) | RECQLMAPK1MAPTTDP1CYP3A4 | |
| SCHEMBL7149069 | 0.77 | MAPK1 (0.54) | RECQLMAPK1MAPTTDP1CYP3A4 | |
| SCHEMBL260911 | 0.77 | ALDH1A1 (0.56) | RECQLMAPK1MAPTTDP1CYP3A4 | |
| SCHEMBL9197870 | 0.77 | MAPK1 (0.54) | RECQLMAPK1MAPTTDP1CYP3A4 | |
| SCHEMBL7868384 | 0.77 | MAPK1 (0.54) | RECQLMAPK1MAPTTDP1CYP3A4 | |
| SCHEMBL15791249 | 0.77 | MAPK1 (0.54) | RECQLMAPK1MAPTTDP1CYP3A4 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111377995-B | Preparation method of prednisolone sodium benzoylsulfonate | 天津药业研究院股份有限公司 | 2022-09-09 | — | — | CN | disclosed |
| US-10711021-B2 | Metal oxide-organic hybrid materials for heterogeneous catalysis and methods of making and using thereof | YALE UNIVERSITY (US) | 2020-07-14 | — | — | US | disclosed |
| US-10081650-B2 | Metal oxide-organic hybrid materials for heterogeneous catalysis and methods of making and using thereof | YALE UNIVERSITY (US) | 2018-09-25 | — | — | US | disclosed |
| US-20160152648-A1 | METAL OXIDE-ORGANIC HYBRID MATERIALS FOR HETEROGENEOUS CATALYSIS AND METHODS OF MAKING AND USING THEREOF | YALE UNIVERSITY | 2016-06-02 | — | — | US | disclosed |
| US-20150065339-A1 | METAL OXIDE-ORGANIC HYBRID MATERIALS FOR HETEROGENEOUS CATALYSIS AND METHODS OF MAKING AND USING THEREOF | NATIONAL SCIENCE FOUNDATION | 2015-03-05 | — | — | US | disclosed |
| US-6326512-B1 | HYDROGENATION A B-KETOSULFONIC ACID COMPOUND | PRESIDENT OF NAGOYA UNIVERSITY (JP) | 2001-12-04 | — | — | US | 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 (4 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-10711021-B2 | Metal oxide-organic hybrid materials for heterogeneous catalysis and methods of making and using thereof | SOD1, SOD3, AS3MT | CA2 5/4885CA4 24/4885CA12 9/4885 |
| US-10081650-B2 | Metal oxide-organic hybrid materials for heterogeneous catalysis and methods of making and using thereof | SOD1, SOD3, AS3MT | CA2 5/4885CA4 24/4885CA12 9/4885 |
| US-20160152648-A1 | METAL OXIDE-ORGANIC HYBRID MATERIALS FOR HETEROGENEOUS CATALYSIS AND METHODS OF MAKING AND USING THEREOF | SOD1, SOD3, AS3MT | CA2 5/4885CA4 24/4885CA12 9/4885 |
| US-20150065339-A1 | METAL OXIDE-ORGANIC HYBRID MATERIALS FOR HETEROGENEOUS CATALYSIS AND METHODS OF MAKING AND USING THEREOF | SOD1, SOD3, AS3MT | CA2 5/4885CA4 24/4885CA12 9/4885 |
“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.