SCHEMBL8696989

SCHEMBL8696989

CCCCn1c(Cc2ccc(-c3ccccc3-c3nnn(C(c4ccccc4)(c4ccccc4)c4ccccc4)n3)cc2)c(C(=O)OCC)cc(C(=O)OCC)c1=O

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 2/20 0.44
AGT P01019 1/20 0.39

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
SCHEMBL8695212 0.90 AGTR1 (0.44) AGTR1
SCHEMBL9058886 0.79 AGTR1 (0.43) AGTR1
SCHEMBL9056688 0.79
SCHEMBL9044903 0.78 AGTR1 (0.42) AGTR1
SCHEMBL7406415 0.78 AGTR1 (0.44) AGTR1
SCHEMBL8695975 0.78 AGTR1 (0.42) AGTR1
SCHEMBL9043115 0.77 AGTR1 (0.41) AGTR1
SCHEMBL9057090 0.77 AGTR1 (0.41) AGTR1
SCHEMBL7277042 0.77 AGT (0.41) AGTR1AGT
SCHEMBL9041709 0.77 AGTR1 (0.41) AGTR1

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-5712296-A Substituted pyridines and 2-oxo-1,2-dihydropyridines BAYER AKTIENGESELLSCHAFT (DE) 1998-01-27 US disclosed
US-5492923-A DRUG FOR TREATING ARTERIAL HYPERTENSION AND ATHEROSCLEROSIS BAYER AKTIENGESELLSCHAFT (DE) 1996-02-20 US disclosed