SCHEMBL21748070

SCHEMBL21748070

COc1cccc(-c2nnc(NS(=O)(=O)C(C)C(C)c3ncc(C)cn3)n2-c2c(OC)cccc2OC)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
APLNR P35414 20/20 1.00

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
SCHEMBL18246392 1.00 APLNR (1.00) APLNR
SCHEMBL18246513 1.00 APLNR (1.00) APLNR
SCHEMBL18245881 0.94 APLNR (1.00) APLNR
SCHEMBL18247148 0.94 APLNR (1.00) APLNR
SCHEMBL18246623 0.94 APLNR (1.00) APLNR
SCHEMBL18246401 0.93 APLNR (1.00) APLNR
SCHEMBL18245936 0.93 APLNR (1.00) APLNR
SCHEMBL18493102 0.93 APLNR (1.00) APLNR
SCHEMBL18245971 0.92 APLNR (1.00) APLNR
SCHEMBL18245801 0.92 APLNR (1.00) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3300500-B9 TRIAZOLE AGONISTS OF THE APJ RECEPTOR AMGEN INC (US) 2021-01-13 EP disclosed
CN-108137545-B Triazole agonists of the APJ receptor 美国安进公司 2020-09-22 CN disclosed
EP-3300500-B1 TRIAZOLE AGONISTS OF THE APJ RECEPTOR AMGEN INC (US) 2020-02-26 EP disclosed