SCHEMBL8540306

SCHEMBL8540306

CCCc1[nH]c(=O)n(CC)c(=O)c1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.42

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC33A1 O00400 9/20 0.42
AGTR1 P30556 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
SCHEMBL8544877 0.94 SLC33A1 (0.47) SLC33A1AGTR1
SCHEMBL8543988 0.92 SLC33A1 (0.43) SLC33A1AGTR1
SCHEMBL8539569 0.87 AGTR1 (0.41) SLC33A1AGTR1
SCHEMBL8543422 0.80 SLC33A1 (0.44) SLC33A1
SCHEMBL9848930 0.80
SCHEMBL9848939 0.79 AGTR1 (0.46) AGTR1
SCHEMBL9848933 0.79 AGTR1 (0.45) AGTR1
SCHEMBL12079721 0.79 PPARG (0.44) SLC33A1AGTR1
SCHEMBL9848924 0.78 AGTR1 (0.43) AGTR1
SCHEMBL9708518 0.78 AGTR1 (0.46) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0442473-B1 Pyrimidinedione derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1998-08-19 EP claimed