SCHEMBL8393294

SCHEMBL8393294

CCCCc1nc2cccc(OC)c2n1-c1ccc(-c2ccccc2C(=O)O)c(C)c1

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 5/20 0.47
AGTR1 P30556 4/20 0.47
APLNR P35414 2/20 0.44

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
SCHEMBL8396647 0.88 ALDH1A1 (0.48) AGTR2AGTR1
SCHEMBL8391541 0.88 AGTR1 (0.41) AGTR2AGTR1APLNR
SCHEMBL8396743 0.86 AGTR1 (0.48) AGTR2AGTR1
SCHEMBL8395685 0.86 AGTR1 (0.45) AGTR2AGTR1APLNR
SCHEMBL8393575 0.85 AGTR2 (0.44) AGTR2AGTR1
SCHEMBL8392455 0.84 AGTR2 (0.43) AGTR2AGTR1
SCHEMBL8392422 0.84 AGTR1 (0.56) AGTR2AGTR1
SCHEMBL8395705 0.83 AGTR2 (0.43) AGTR2AGTR1
SCHEMBL8393675 0.82 PPARG (0.49) AGTR2AGTR1
SCHEMBL8395220 0.82 PPARG (0.49) AGTR2AGTR1

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-5864043-A CARDIOVASCULAR DISORDERS AND ANGIOTENSIN ANTAGONIST KARL THOMAE GMBH (DE) 1999-01-26 US disclosed