SCHEMBL8395685

SCHEMBL8395685

CCCCc1nc2c(OC)cccc2n1-c1ccc(-c2ccccc2C(=O)O)c(C)c1

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 3/20 0.45
AGTR2 P50052 3/20 0.45
APLNR P35414 3/20 0.44
PPARG P37231 1/20 0.43
PDE10A Q9Y233 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
SCHEMBL8396608 0.88 PPARG (0.45) AGTR1AGTR2PPARG
SCHEMBL8396743 0.86 AGTR1 (0.48) AGTR1AGTR2
SCHEMBL8393294 0.86 AGTR2 (0.47) AGTR1AGTR2APLNR
SCHEMBL8391541 0.86 AGTR1 (0.41) AGTR1AGTR2APLNR
SCHEMBL8394947 0.85 PPARG (0.43) AGTR1AGTR2PPARG
SCHEMBL8393826 0.84 AGTR1 (0.45) AGTR1AGTR2PPARG
SCHEMBL8392422 0.84 AGTR1 (0.56) AGTR1AGTR2PPARG
SCHEMBL8391178 0.83 AGTR1 (0.46) AGTR1AGTR2PPARG
SCHEMBL8393675 0.82 PPARG (0.49) AGTR1AGTR2PPARG
SCHEMBL8395220 0.82 PPARG (0.49) AGTR1AGTR2PPARGPDE10A

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