SCHEMBL8031320

SCHEMBL8031320

CCCCc1nc(C)n(Cc2sccc2C(=O)NC)c(=O)c1Cc1ccc(-c2ccccc2-c2nnnn2C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 1/20 0.44
AGTR2 P50052 1/20 0.44
AGT P01019 2/20 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
SCHEMBL8979804 0.93 AGT (0.45) AGTR1AGTR2AGT
SCHEMBL8028180 0.93 AGTR1 (0.45) AGTR1AGTR2AGT
SCHEMBL8028153 0.90 AGTR1 (0.47) AGTR1AGTR2AGT
SCHEMBL8034108 0.88 AGTR1 (0.45) AGTR1AGTR2AGT
SCHEMBL9274865 0.87 AGT (0.43) AGTR1AGTR2AGT
SCHEMBL8028318 0.87 AGTR1 (0.44) AGTR1AGTR2AGT
SCHEMBL8018483 0.85
SCHEMBL8979874 0.83 AGT (0.51) AGTR1AGTR2AGT
SCHEMBL8034105 0.83 AGTR1 (0.47) AGTR1AGTR2AGT
SCHEMBL8028326 0.82 AGTR1 (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-6096754-A N-3 substituted pyrimidin-4-ones with AII antagonistic activity ISTITUTO LUSO FARMACO D'ITALIA S.P.A. (IT) 2000-08-01 US disclosed