SCHEMBL20207611

SCHEMBL20207611

COc1cc[nH]c(=O)c1-n1c(C)nnc1-c1ccn(C)n1

nearest known ligand 0.55

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
APLNR P35414 20/20 0.55

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
SCHEMBL20207486 0.83 APLNR (0.55) APLNR
SCHEMBL20207325 0.81 APLNR (0.65) APLNR
SCHEMBL20207457 0.78 APLNR (0.54) APLNR
SCHEMBL20207395 0.75 APLNR (0.52) APLNR
SCHEMBL20189494 0.73 APLNR (1.00) APLNR
SCHEMBL20189492 0.73 APLNR (1.00) APLNR
SCHEMBL20190081 0.69 APLNR (0.64) APLNR
SCHEMBL20187765 0.69 APLNR (0.62) APLNR
SCHEMBL28501842 0.68 APLNR (0.60) APLNR
SCHEMBL23002416 0.67 APLNR (0.59) 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-2018097945-A1 HETEROARYL-SUBSTITUTED TRIAZOLES AS APJ RECEPTOR AGONISTS AMGEN INC. (US) 2018-05-31 WO disclosed