SCHEMBL20200872

SCHEMBL20200872

COc1cccc(OC)c1-n1c(NSC(CCOCc2ccccc2)Cc2ncc(C)cn2)nnc1-c1ccc(C)o1

nearest known ligand 0.58

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
APLNR P35414 20/20 0.58

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
SCHEMBL20200277 0.87 APLNR (0.70) APLNR
SCHEMBL20190066 0.84 APLNR (0.82) APLNR
SCHEMBL20190067 0.84 APLNR (0.82) APLNR
SCHEMBL20190153 0.84 APLNR (0.82) APLNR
SCHEMBL20201032 0.83 APLNR (0.70) APLNR
SCHEMBL20200288 0.81 APLNR (0.69) APLNR
SCHEMBL20200735 0.81 APLNR (0.69) APLNR
SCHEMBL20200756 0.77 APLNR (0.71) APLNR
SCHEMBL22810439 0.76 APLNR (0.69) APLNR
SCHEMBL22810457 0.75 APLNR (0.70) APLNR

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-2018097944-A1 TRIAZOLE FURAN COMPOUNDS AS AGONISTS OF THE APJ RECEPTOR AMGEN INC. (US) 2018-05-31 WO disclosed