SCHEMBL22912159

SCHEMBL22912159

COc1cccc(OC)c1-n1c(CCC2CC2)nc(=O)c(-c2nnc(Cc3ccc(C)cn3)o2)c1O

nearest known ligand 0.48

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ APLNR P35414 20/20 0.48

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
SCHEMBL20584790 0.93 APLNR (0.49) APLNR
SCHEMBL20584451 0.92 APLNR (0.54) APLNR
SCHEMBL22912191 0.89 APLNR (0.41) APLNR
SCHEMBL20584563 0.87 APLNR (0.55) APLNR
SCHEMBL19001438 0.85 APLNR (0.39) APLNR
SCHEMBL20584407 0.84 APLNR (0.53) APLNR
SCHEMBL19001460 0.84 APLNR (0.40) APLNR
SCHEMBL19001458 0.82 APLNR (0.49) APLNR
SCHEMBL19001448 0.82 APLNR (0.41) APLNR
SCHEMBL20584793 0.82 APLNR (0.38) 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
EP-3390400-B1 HETEROARYLHYDROXYPYRIMIDINONES AS AGONISTS OF THE APJ RECEPTOR BRISTOL MYERS SQUIBB CO (US) 2021-01-20 — — EP disclosed
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