SCHEMBL9709767

SCHEMBL9709767

Cc1cc(N(Cc2ccc(-c3ccccc3-c3nnnn3C(c3ccccc3)(c3ccccc3)c3ccccc3)cc2)C(=O)OC(C)(C)C)c2ccc(C)c(C)c2n1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AGT P01019 2/20 0.39
AGTR1 P30556 5/20 0.39
AGTR2 P50052 2/20 0.39
GRM2 Q14416 1/20 0.32
CRHR1 P34998 1/20 0.31
MCL1 Q07820 1/20 0.31

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
SCHEMBL9709627 0.85 AGTR1 (0.38) AGTAGTR1AGTR2
SCHEMBL9709716 0.83 AGT (0.41) AGTAGTR1AGTR2
SCHEMBL9709690 0.82 AGTR1 (0.44) AGTAGTR1AGTR2
SCHEMBL9709712 0.80 AGT (0.41) AGTAGTR1AGTR2
SCHEMBL9709580 0.79 AGT (0.35) AGTAGTR1AGTR2
SCHEMBL9709746 0.79 AGTR1 (0.39) AGTAGTR1AGTR2
SCHEMBL9709871 0.78 AGT (0.45) AGTAGTR1AGTR2
SCHEMBL21065255 0.76 AGTR1 (0.39) AGTAGTR1AGTR2
SCHEMBL16824592 0.73 AGTR1 (0.37) AGTAGTR1AGTR2
SCHEMBL21065260 0.72 LTB4R2 (0.38) AGTAGTR1AGTR2

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
WO-1992022533-A1 4-AMINOQUINOLINES AND PHARMACEUTICAL COMPOSITIONS THEREOF THE UPJOHN COMPANY (US) 1992-12-23 WO disclosed