SCHEMBL5674182

SCHEMBL5674182

NC1(O)C=Nc2ccccc21

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.33
PDK2 Q15119 1/20 0.30

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
SCHEMBL5851114 0.77 ADORA3 (0.35) ADORA3PDK2
SCHEMBL3124906 0.74 ADORA3 (0.33) ADORA3PDK2
SCHEMBL5486167 0.74 HTR5A (0.33) ADORA3PDK2
SCHEMBL14575103 0.74 ADORA3 (0.33) ADORA3PDK2
SCHEMBL28499297 0.72 ADORA3 (0.33) ADORA3
SCHEMBL9620915 0.71
SCHEMBL28806304 0.71 P2RX1 (0.35) ADORA3
SCHEMBL31738480 0.69
SCHEMBL28330586 0.69
SCHEMBL30876182 0.68

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1235927-B1 NOVEL ENZYMATIC SUBSTRATES FOR DETECTING PSEUDOMONAS AERUGINOSA BIOMERIEUX SA (FR) 2006-03-08 EP claimed
EP-1621530-A1 Methods, compositions et enzyme substrates for the detection of Pseudomonas Aeruginosa BIOMERIEUX SA (FR) 2006-02-01 EP claimed
US-6905841-B2 Enzymatic substrates for detecting Pseudomonas aeruginas BIOMERIEUX S.A. (FR) 2005-06-14 US claimed
CN-1408026-A Novel enzyme substrates for the detection of Pseudomonas aeruginosa, compositions containing them, and methods for detecting this species BIOMERIEUX SA (FR) 2003-04-02 CN claimed
US-20030044877-A1 Novel enzymatic substrates for detecting pseudomonas aeruginosa, compositions containing same and method for detecting said species BIOMERIEUX S.A. (FR) 2003-03-06 US claimed
EP-1235927-A2 NOVEL ENZYMATIC SUBSTRATES FOR DETECTING PSEUDOMONAS AERUGINOSA Biomerieux S.A. (FR) 2002-09-04 EP claimed
WO-2001042491-A2 NOVEL ENZYMATIC SUBSTRATES FOR DETECTING PSEUDOMONAS AERUGINOSA BIOMERIEUX S.A. (FR) 2001-06-14 WO claimed
CN-101142184-A Sulfonamide peri-substituted bicyclics for occlusive artery disease DECODE GENETICS INC (IS) 2008-03-12 CN disclosed
EP-1235927-B1 NOVEL ENZYMATIC SUBSTRATES FOR DETECTING PSEUDOMONAS AERUGINOSA BIOMERIEUX SA (FR) 2006-03-08 EP disclosed
EP-1621530-A1 Methods, compositions et enzyme substrates for the detection of Pseudomonas Aeruginosa BIOMERIEUX SA (FR) 2006-02-01 EP disclosed
US-6905841-B2 Enzymatic substrates for detecting Pseudomonas aeruginas BIOMERIEUX S.A. (FR) 2005-06-14 US disclosed
CN-1408026-A Novel enzyme substrates for the detection of Pseudomonas aeruginosa, compositions containing them, and methods for detecting this species BIOMERIEUX SA (FR) 2003-04-02 CN disclosed
US-20030044877-A1 Novel enzymatic substrates for detecting pseudomonas aeruginosa, compositions containing same and method for detecting said species BIOMERIEUX S.A. (FR) 2003-03-06 US disclosed
EP-1235927-A2 NOVEL ENZYMATIC SUBSTRATES FOR DETECTING PSEUDOMONAS AERUGINOSA Biomerieux S.A. (FR) 2002-09-04 EP disclosed
WO-2001042491-A2 NOVEL ENZYMATIC SUBSTRATES FOR DETECTING PSEUDOMONAS AERUGINOSA BIOMERIEUX S.A. (FR) 2001-06-14 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.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030044877-A1 Novel enzymatic substrates for detecting pseudomonas aeruginosa, compositions containing same and method for detecting said species PEPD, ENPEP, ANPEP ADORA3 1767/4885PDK2 1072/4885

“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.