SCHEMBL9588595

SCHEMBL9588595

CCCCN(Cc1ccc(-c2ccccc2-c2nnnn2C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1)c1ncncc1C(=O)OCC

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 15/20 0.54
AGTR2 P50052 15/20 0.54
AGT P01019 1/20 0.43

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
SCHEMBL9591658 0.95 AGTR1 (0.54) AGTR1AGTR2AGT
SCHEMBL9589952 0.94 AGTR1 (0.54) AGTR1AGTR2
SCHEMBL9591356 0.94 AGTR1 (0.52) AGTR1AGTR2AGT
SCHEMBL9589748 0.94 AGTR1 (0.53) AGTR1AGTR2
SCHEMBL9682917 0.93 AGTR1 (0.51) AGTR1AGTR2AGT
SCHEMBL9589934 0.93 AGTR1 (0.63) AGTR1AGTR2
SCHEMBL9591033 0.91 AGTR1 (0.49) AGTR1AGTR2AGT
SCHEMBL9590194 0.90 AGTR1 (0.55) AGTR1AGTR2AGT
SCHEMBL9592483 0.90 AGTR1 (0.52) AGTR1AGTR2
SCHEMBL9590144 0.90 AGTR1 (0.54) AGTR1AGTR2AGT

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-5250548-A Treating hypertension, heart failure ABBOTT LABORATORIES (US) 1993-10-05 US disclosed
EP-0475206-A2 Angiotensin II receptor antagonists ABBOTT LABORATORIES (US) 1992-03-18 EP disclosed