SCHEMBL21767102

SCHEMBL21767102

COc1cccc(OC)c1-n1c(NSC(C)C(OCCO)c2ncc(C)cn2)nnc1-c1cncc(C)c1

nearest known ligand 0.73

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
APLNR P35414 20/20 0.73

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
SCHEMBL21767020 0.91 APLNR (0.72) APLNR
SCHEMBL21767045 0.89 APLNR (0.71) APLNR
SCHEMBL18531512 0.86 APLNR (0.70) APLNR
SCHEMBL22889821 0.86 APLNR (0.73) APLNR
SCHEMBL21767144 0.86 APLNR (0.73) APLNR
SCHEMBL18245953 0.85 APLNR (1.00) APLNR
SCHEMBL18245608 0.85 APLNR (1.00) APLNR
SCHEMBL18245719 0.85 APLNR (1.00) APLNR
SCHEMBL18245578 0.85 APLNR (1.00) APLNR
SCHEMBL21767060 0.84 APLNR (0.73) 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-3300500-B1 TRIAZOLE AGONISTS OF THE APJ RECEPTOR AMGEN INC (US) 2020-02-26 EP disclosed