SCHEMBL7828610

SCHEMBL7828610

C#CCCc1nn(C(=O)Cc2ccccc2)c(=O)n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 10/20 0.41
AGTR2 P50052 10/20 0.41

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
SCHEMBL7833633 0.91 AGTR1 (0.43) AGTR1AGTR2
SCHEMBL7830353 0.89 AGTR1 (0.44) AGTR1AGTR2
SCHEMBL7829568 0.89 AGTR1 (0.43) AGTR1AGTR2
SCHEMBL7833858 0.89 AGTR1 (0.48) AGTR1AGTR2
SCHEMBL7819298 0.88 AGTR1 (0.46) AGTR1AGTR2
SCHEMBL7818720 0.88 AGTR1 (0.55) AGTR1AGTR2
SCHEMBL7828634 0.87 AGTR1 (0.44) AGTR1AGTR2
SCHEMBL7830843 0.87 AGTR1 (0.53) AGTR1AGTR2
SCHEMBL7830142 0.87 AGTR1 (0.52) AGTR1AGTR2
SCHEMBL7826360 0.87 AGTR1 (0.43) AGTR1AGTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010020100-A1 N-substituted-1, 2, 4-triazolone compounds for treatment of cardiovascular disorders G.D. SEARLE & CO. (US) 2001-09-06 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 (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-20010020100-A1 N-substituted-1, 2, 4-triazolone compounds for treatment of cardiovascular disorders NR3C2, AGTR1, PAH AGTR1 2/4885AGTR2 8/4885

“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.