SCHEMBL9296557

SCHEMBL9296557

CCCN(Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1)c1ncc(C(=O)O)s1

nearest known ligand 0.72

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 20/20 0.72
AGTR2 P50052 20/20 0.72

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
SCHEMBL9296083 0.95 AGTR1 (0.73) AGTR1AGTR2
SCHEMBL9295812 0.93 AGTR1 (0.74) AGTR1AGTR2
SCHEMBL9296073 0.92 AGTR1 (0.62) AGTR1AGTR2
SCHEMBL9296100 0.85 AGTR1 (0.60) AGTR1AGTR2
SCHEMBL9296443 0.84 AGTR1 (0.52) AGTR1AGTR2
SCHEMBL9223583 0.83 AGTR1 (0.73) AGTR1AGTR2
SCHEMBL9680988 0.83 AGTR1 (0.65) AGTR1AGTR2
SCHEMBL9682969 0.81 AGTR1 (0.66) AGTR1AGTR2
SCHEMBL9295946 0.80 AGTR1 (0.50) AGTR1AGTR2
SCHEMBL9589295 0.80 AGTR1 (0.58) 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-5326776-A Tetrazoles ABBOTT LABORATORIES (US) 1994-07-05 US disclosed