Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.47 |
| ▸ | CCNC | P24863 | 1/20 | 0.47 |
| ▸ | CDK8 | P49336 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.46 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | EGFR | P00533 | 1/20 | 0.44 |
| ▸ | SRC | P12931 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | FLT1 | P17948 | 2/20 | 0.42 |
| ▸ | KDR | P35968 | 2/20 | 0.42 |
| ▸ | CASP3 | P42574 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7208445 | 0.85 | CYP4F2 (0.60) | KDM4ELOXL2CYP1A2ALDH1A1SMN1; SMN2 | |
| SCHEMBL5177349 | 0.83 | LOXL2 (0.43) | KDM4ELOXL2CYP1A2MTNR1AMTNR1B | |
| SCHEMBL17537545 | 0.82 | ALDH1A1 (0.54) | KDM4ECCNCCDK8CYP1A2ALDH1A1 | |
| SCHEMBL1650885 | 0.81 | CYP1A2 (0.55) | KDM4ELOXL2CCNCCDK8CYP1A2 | |
| SCHEMBL21820692 | 0.80 | LOXL2 (0.49) | LOXL2CYP1A2MTNR1AMTNR1BALDH1A1 | |
| SCHEMBL5514406 | 0.80 | LOXL2 (0.51) | KDM4ELOXL2CYP1A2ALDH1A1SMN1; SMN2 | |
| SCHEMBL2846594 | 0.79 | CYP1A2 (0.42) | LOXL2CYP1A2MTNR1AMTNR1BALDH1A1 | |
| SCHEMBL13604226 | 0.78 | ALDH1A1 (0.55) | KDM4ELOXL2CYP1A2MTNR1AMTNR1B | |
| SCHEMBL22345389 | 0.78 | KDM4E (0.49) | KDM4ECCNCCDK8CYP1A2ALDH1A1 | |
| Iodide SCHEMBL22345444 | 0.77 | KDM4E (0.46) | KDM4ECCNCCDK8CYP1A2ALDH1A1 |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5939268-A | DIELS-ALDER REACTION PRODUCT OF A DIENE AND A DIENOPHILE; CHEMICAL INTERMEDIATES FOR DRUGS, SOLID PHASE SYNTHESIS | THE SCRIPPS RESEARCH INSTITUTE (US) | 1999-08-17 | — | — | US | claimed |
| EP-0773953-A1 | COMBINATORIAL LIBRARIES OF MOLECULES AND METHODS FOR PRODUCING SAME | THE SCRIPPS INSTITUTE (US) | 1997-05-21 | — | — | EP | claimed |
| WO-1996003424-A1 | COMBINATORIAL LIBRARIES OF MOLECULES AND METHODS FOR PRODUCING SAME | THE SCRIPPS RESEARCH INSTITUTE (US) | 1996-02-08 | — | — | WO | claimed |
| US-20090105301-A1 | 9A-SUBSTITUTED AZALIDES FOR THE TREATMENT OF MALARIA | GLAXOSMITHKLINE ISTRAZIVACKI CENTER ZAGREB D.O.O (HR) | 2009-04-23 | — | — | US | disclosed |
| US-20090105301-A1 | 9A-SUBSTITUTED AZALIDES FOR THE TREATMENT OF MALARIA | GLAXOSMITHKLINE ISTRAZIVACKI CENTER ZAGREB D.O.O (HR) | 2009-04-23 | — | — | US | disclosed |
| US-20090105301-A1 | 9A-SUBSTITUTED AZALIDES FOR THE TREATMENT OF MALARIA | GLAXOSMITHKLINE ISTRAZIVACKI CENTER ZAGREB D.O.O (HR) | 2009-04-23 | — | — | US | disclosed |
| EP-2012776-A2 | 9A-SUBSTITUTED AZALIDES | GlaxoSmithKline istrazivacki centar Zagreb d.o.o. (HR) | 2009-01-14 | — | — | EP | disclosed |
| WO-2007125414-A2 | 9A-SUBSTITUTED AZALIDES FOR THE TRATMENT OF MALARIA | GLAXOSMITHKLINE ISTRAZIVACKI CENTAR ZAGREB D.O.O. (GB) | 2007-11-08 | — | — | WO | disclosed |
| WO-2007125414-A2 | 9A-SUBSTITUTED AZALIDES FOR THE TRATMENT OF MALARIA | GLAXOSMITHKLINE ISTRAZIVACKI CENTAR ZAGREB D.O.O. (GB) | 2007-11-08 | — | — | WO | disclosed |
| US-5939268-A | DIELS-ALDER REACTION PRODUCT OF A DIENE AND A DIENOPHILE; CHEMICAL INTERMEDIATES FOR DRUGS, SOLID PHASE SYNTHESIS | THE SCRIPPS RESEARCH INSTITUTE (US) | 1999-08-17 | — | — | US | disclosed |
| EP-0773953-A1 | COMBINATORIAL LIBRARIES OF MOLECULES AND METHODS FOR PRODUCING SAME | THE SCRIPPS INSTITUTE (US) | 1997-05-21 | — | — | EP | disclosed |
| WO-1996003424-A1 | COMBINATORIAL LIBRARIES OF MOLECULES AND METHODS FOR PRODUCING SAME | THE SCRIPPS RESEARCH INSTITUTE (US) | 1996-02-08 | — | — | 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-20090105301-A1 | 9A-SUBSTITUTED AZALIDES FOR THE TREATMENT OF MALARIA | DHCR7, DHODH, QDPR | KDM4E 104/4885LOXL2 4644/4885CCNC 2854/4885 |
“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.