SCHEMBL20200817

SCHEMBL20200817

COCC1CCCC(=O)N1CCSNc1nnc(-c2ccco2)n1-c1c(OC)cccc1OC

nearest known ligand 0.76

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
APLNR P35414 20/20 0.76

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
SCHEMBL20200785 0.90 APLNR (0.75) APLNR
SCHEMBL20201043 0.90 APLNR (0.75) APLNR
SCHEMBL20190140 0.86 APLNR (1.00) APLNR
SCHEMBL20189824 0.86 APLNR (1.00) APLNR
SCHEMBL20200731 0.81 APLNR (0.74) APLNR
SCHEMBL22810416 0.81 APLNR (0.59) APLNR
SCHEMBL20200380 0.78 APLNR (0.57) APLNR
SCHEMBL20201166 0.78 APLNR (0.52) APLNR
SCHEMBL20201045 0.77 APLNR (0.51) APLNR
SCHEMBL22810430 0.77 APLNR (0.53) 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