SCHEMBL20201161

SCHEMBL20201161

COc1cccc(OC)c1-n1c(NSCCC(O)C2CCCCC2)nnc1-c1ccco1

nearest known ligand 0.51

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
APLNR P35414 20/20 0.51

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
SCHEMBL20201137 0.99 APLNR (0.51) APLNR
SCHEMBL20201169 0.90 APLNR (0.55) APLNR
SCHEMBL20187895 0.84 APLNR (0.64) APLNR
SCHEMBL20189924 0.84 APLNR (0.64) APLNR
SCHEMBL20189925 0.84 APLNR (0.64) APLNR
SCHEMBL20190084 0.83 APLNR (0.65) APLNR
SCHEMBL20190086 0.83 APLNR (0.65) APLNR
SCHEMBL20190257 0.83 APLNR (0.65) APLNR
SCHEMBL22537315 0.82 APLNR (0.50) APLNR
SCHEMBL20201166 0.82 APLNR (0.52) 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