SCHEMBL7318558

SCHEMBL7318558

CCCc1nc2nncn2c(O)c1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.52

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 1/20 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
SCHEMBL7310948 0.85
SCHEMBL9308719 0.84 AGTR1 (0.50) AGTR1
SCHEMBL7310843 0.84 SLC33A1 (0.41)
SCHEMBL9258470 0.83
SCHEMBL7315139 0.81
Hydrochloric Acid SCHEMBL7322654 0.81
SCHEMBL9725027 0.80 AGTR1 (0.42) AGTR1
SCHEMBL9252852 0.80 PPARG (0.46) AGTR1
SCHEMBL9254444 0.77 SLC33A1 (0.48)
SCHEMBL9258857 0.76 SLC33A1 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5387747-A Used in the treatment and prevention of cardiovascular diseases: hypertension, cardiac insufficiency and atherosclerosis LABORATOIRES UPSA (FR) 1995-02-07 US disclosed
US-5231094-A Cardiovascular disorders SOCIETE ANONYME: LABORATOIRES UPSA (FR) 1993-07-27 US disclosed