SCHEMBL20200317

SCHEMBL20200317

COc1cccc(OC)c1-n1c(NS)nnc1-c1ccco1

nearest known ligand 0.57

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
APLNR P35414 20/20 0.57

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
SCHEMBL20201307 0.85 APLNR (0.56) APLNR
SCHEMBL22810450 0.83 APLNR (0.54) APLNR
SCHEMBL20190756 0.83 APLNR (0.67) APLNR
SCHEMBL20200838 0.82 APLNR (0.54) APLNR
SCHEMBL20191039 0.81 APLNR (0.52) APLNR
SCHEMBL20190224 0.81 APLNR (0.57) APLNR
SCHEMBL22810430 0.80 APLNR (0.53) APLNR
SCHEMBL20201014 0.79 APLNR (0.56) APLNR
SCHEMBL20190232 0.78 APLNR (0.74) APLNR
SCHEMBL20201045 0.78 APLNR (0.51) 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