SCHEMBL2979571

SCHEMBL2979571

N#CCCCCc1nnn[nH]1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 2/20 0.33
EPAS1 Q99814 2/20 0.33

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL1303281 0.86
SCHEMBL2705361 0.83 L3MBTL1 (0.32)
SCHEMBL16752678 0.81 L3MBTL1 (0.36)
SCHEMBL4785199 0.74 ALDH1A1 (0.30)
SCHEMBL4681202 0.74 ALDH1A1 (0.38)
SCHEMBL4671779 0.73
SCHEMBL1656311 0.73
SCHEMBL6050117 0.72 L3MBTL1 (0.30)
SCHEMBL416603 0.72 L3MBTL1 (0.30)
SCHEMBL1128201 0.72 L3MBTL1 (0.30)

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7776896-B2 5-cyano-prostacyclin derivatives as agents for the treatment of influenza a viral infection BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-08-17 US disclosed
EP-2142524-A1 NOVEL 5-CYANO-PROSTACYCLIN DERIVATIVES AND THEIR USE AS AGENTS FOR THE TREATMENT OF INFLUENZA A VIRAL INFECTION Bayer Schering Pharma Aktiengesellschaft (DE) 2010-01-13 EP disclosed
EP-1988087-A1 Novel 5-cyano-prostacyclin derivatives and their use as agents for the treatment of autoimmune diseases Bayer Schering Pharma Aktiengesellschaft (DE) 2008-11-05 EP disclosed
US-20080242714-A1 Novel 5-cyano-prostacyclin derivatives as agents for the treatment of influenza a viral infection BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-10-02 US disclosed
US-20080242713-A1 Novel 5-cyano-prostacyclin derivatives as agents for the treatment of autoimmune diseases BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-10-02 US disclosed
WO-2008116670-A1 NOVEL 5-CYANO-PROSTACYCLIN DERIVATIVES AND THEIR USE AS AGENTS FOR THE TREATMENT OF AUTOIMMUNE DISEASES BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-10-02 WO disclosed
WO-2008116669-A1 NOVEL 5-CYANO-PROSTACYCLIN DERIVATIVES AND THEIR USE AS AGENTS FOR THE TREATMENT OF INFLUENZA A VIRAL INFECTION BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-10-02 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 (2 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.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080242713-A1 Novel 5-cyano-prostacyclin derivatives as agents for the treatment of autoimmune diseases PTGIR, PTGIS, PTGER1 HIF1A 1972/4885EPAS1 344/4885
US-20080242714-A1 Novel 5-cyano-prostacyclin derivatives as agents for the treatment of influenza a viral infection PTGIR, PTGER1, PTGIS HIF1A 425/4885EPAS1 271/4885

“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.