Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MIF | P14174 | 11/20 | 1.00 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.64 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.64 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.64 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.64 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.64 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.64 |
| ▸ | ESR1 | P03372 | 1/20 | 0.52 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.52 |
| ▸ | NAAA | Q02083 | 4/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | HTR1A | P08908 | 1/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | HTR3A | P46098 | 1/20 | 0.45 |
| ▸ | BACE1 | P56817 | 1/20 | 0.45 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL332410 | 0.89 | MIF (0.79) | MIFTRPA1CYP2E1CYP2A6HIF1A | |
| SCHEMBL8763660 | 0.83 | MIF (0.70) | MIFTRPA1CYP2E1CYP2A6HIF1A | |
| SCHEMBL3364900 | 0.79 | MIF (0.66) | MIFTRPA1CYP2E1CYP2A6HIF1A | |
| SCHEMBL3967224 | 0.79 | MIF (0.66) | MIFTRPA1CYP2E1CYP2A6HIF1A | |
| SCHEMBL27850331 | 0.79 | MIF (0.66) | MIFTRPA1HIF1AESR1ESR2 | |
| SCHEMBL9116288 | 0.79 | MIF (0.92) | MIFTRPA1CYP2E1CYP2A6HIF1A | |
| SCHEMBL1457483 | 0.79 | MIF (1.00) | MIFTRPA1CYP2E1CYP2A6HIF1A | |
| SCHEMBL17971512 | 0.79 | MIF (1.00) | MIFTRPA1CYP2E1CYP2A6HIF1A | |
| SCHEMBL30668504 | 0.79 | MIF (1.00) | MIFTRPA1CYP2E1CYP2A6HIF1A | |
| Phenethylisothiocyanate SCHEMBL156960 | 0.78 | MIF (1.00) | MIFTRPA1CYP2E1CYP2A6HIF1A |
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 19 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010140902-A1 | INHIBITORS OF MACROPHAGE MIGRATION INHIBITORY FACTOR | HAMPTON MARK (NZ) | 2010-12-09 | — | — | WO | claimed |
| US-8859798-B2 | Isothiocyanate compounds, pharmaceutical compositions, and uses thereof | RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) | 2014-10-14 | — | — | US | disclosed |
| US-8859798-B2 | Isothiocyanate compounds, pharmaceutical compositions, and uses thereof | RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) | 2014-10-14 | — | — | US | disclosed |
| US-20090291989-A1 | ISOTHIOCYANATE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF | UNIVERSITY OF MEDICINE AND DENTISTRY OF NEW JERSEY (US) | 2009-11-26 | — | — | US | disclosed |
| EP-1281405-B1 | Short-chained peptide-dye conjugates as contrast agents for optical diagnosis | DIAGNOSTIKFORSCHUNG INST (DE) | 2009-01-21 | — | — | EP | disclosed |
| US-7312326-B2 | Fluorescent labeled nucleotide derivatives | BECKMAN COULTER, INC. (US) | 2007-12-25 | — | — | US | disclosed |
| US-7312326-B2 | Fluorescent labeled nucleotide derivatives | BECKMAN COULTER, INC. (US) | 2007-12-25 | — | — | US | disclosed |
| US-7312326-B2 | Fluorescent labeled nucleotide derivatives | BECKMAN COULTER, INC. (US) | 2007-12-25 | — | — | US | disclosed |
| US-7175953-B2 | Short-warp peptide-dye conjugate as contrast agent for optical diagnostic | INSTITUTE FUER DIAGNOSTIK FORSCHUNG (DE) | 2007-02-13 | — | — | US | disclosed |
| EP-1732989-A1 | FLUORESCENT LABELED NUCLEOTIDE DERIVATIVES | Beckman Coulter, Inc. (US) | 2006-12-20 | — | — | EP | disclosed |
| US-20060036072-A1 | Short-warp peptide dye conjugate as contrast agent for optical diagnostic | INSTITUT FUR DIAGNOSTIKFORSCHUNG GMBH (DE) | 2006-02-16 | — | — | US | disclosed |
| WO-2005103162-A1 | FLUORESCENT LABELED NUCLEOTIDE DERIVATIVES | BECKMAN COULTER, INC. (US) | 2005-11-03 | — | — | WO | disclosed |
| US-20050227240-A1 | Fluorescent labeled nucleotide derivatives | BECKMAN COULTER, INC. | 2005-10-13 | — | — | US | disclosed |
| EP-1176987-B1 | SHORT-CHAIN PEPTIDE DYE CONJUGATES USED AS CONTRAST AGENTS FOR OPTICAL DIAGNOSTICS | DIAGNOSTIKFORSCHUNG INST (DE) | 2004-02-11 | — | — | EP | disclosed |
| US-6630570-B1 | Of tumor cells and tissues; derived from vaso-active intestinal protein, somatostatin or neurotensin; methine/cyanine; useful for endoscopy | Insitut für Diagnostikforschung GmbH (DE) | 2003-10-07 | — | — | US | disclosed |
| EP-1281405-A2 | Short-chained peptide-dye conjugates as contrast agents for optical diagnosis | INSTITUT FÜR DIAGNOSTIKFORSCHUNG GmbH AN DER FREIEN UNIVERSITÄT BERLIN (DE) | 2003-02-05 | — | — | EP | disclosed |
| CN-1351505-A | Short-chain peptide dye conjagates used as contrast agents for optical diagnostics | DIAGNOSTIKFORSCHUNG INST (DE) | 2002-05-29 | — | — | CN | disclosed |
| EP-1176987-A2 | SHORT-CHAIN PEPTIDE DYE CONJUGATES USED AS CONTRAST AGENTS FOR OPTICAL DIAGNOSTICS | INSTITUT FÜR DIAGNOSTIKFORSCHUNG GmbH AN DER FREIEN UNIVERSITÄT BERLIN (DE) | 2002-02-06 | — | — | EP | disclosed |
| WO-2000061194-A2 | SHORT-CHAIN PEPTIDE DYE CONJUGATES USED AS CONTRAST AGENTS FOR OPTICAL DIAGNOSTICS | Institut für Diagnostikforschung GmbH an der Freien Universität Berlin (DE) | 2000-10-19 | — | — | 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 (3 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-20060036072-A1 | Short-warp peptide dye conjugate as contrast agent for optical diagnostic | VIP, VASP, IAPP | MIF 1343/4885TRPA1 1277/4885CYP2E1 4880/4885 |
| US-20090291989-A1 | ISOTHIOCYANATE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF | TST, TREH, NFATC1 | MIF 545/4885TRPA1 93/4885CYP2E1 739/4885 |
| US-20050227240-A1 | Fluorescent labeled nucleotide derivatives | RNGTT, DNTT, POLRMT | MIF 4143/4885TRPA1 3889/4885CYP2E1 4281/4885 |
“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.