SCHEMBL20200285

SCHEMBL20200285

COc1cccc(OC)c1-n1c(N[S+]([O-])C(C)Cc2ncc(Cl)cc2C#N)nnc1-c1ccco1

nearest known ligand 0.72

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
APLNR P35414 20/20 0.72

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
SCHEMBL20200183 0.92 APLNR (0.72) APLNR
SCHEMBL20200190 0.87 APLNR (0.66) APLNR
SCHEMBL20200788 0.85 APLNR (0.74) APLNR
SCHEMBL20189520 0.84 APLNR (1.00) APLNR
SCHEMBL20189523 0.84 APLNR (1.00) APLNR
SCHEMBL20190198 0.84 APLNR (1.00) APLNR
SCHEMBL22810431 0.81 APLNR (0.68) APLNR
SCHEMBL20188226 0.79 APLNR (0.77) APLNR
SCHEMBL20200262 0.79 APLNR (0.74) APLNR
SCHEMBL20200309 0.77 APLNR (0.69) 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