SCHEMBL9603396

SCHEMBL9603396

CCCCN(Cc1ccc(-c2ccccc2-c2nnnn2C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1)c1nnc(Cl)cc1C(=O)OCC

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 16/20 0.56
AGTR2 P50052 16/20 0.56
AGT P01019 1/20 0.47

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
SCHEMBL9590162 0.95 AGTR1 (0.54) AGTR1AGTR2AGT
SCHEMBL9590267 0.87 AGTR1 (0.55) AGTR1AGTR2AGT
SCHEMBL9590144 0.87 AGTR1 (0.54) AGTR1AGTR2AGT
SCHEMBL9589702 0.87 AGTR1 (0.51) AGTR1AGTR2AGT
SCHEMBL9590194 0.86 AGTR1 (0.55) AGTR1AGTR2AGT
SCHEMBL9588595 0.86 AGTR1 (0.54) AGTR1AGTR2AGT
SCHEMBL9295969 0.85 AGTR1 (0.58) AGTR1AGTR2AGT
SCHEMBL9589082 0.85 AGTR1 (0.52) AGTR1AGTR2AGT
SCHEMBL9296891 0.84 AGT (0.44) AGTR1AGTR2AGT
SCHEMBL9542915 0.84 AGT (0.46) 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 1 patent. 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