SCHEMBL28458774

SCHEMBL28458774

COc1cccc(OC)c1-n1c(NS(=O)(=O)C(C)C(OC)c2ncc(C)cn2)nnc1-c1ccncc1

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
SCHEMBL18246016 1.00 APLNR (1.00) APLNR
SCHEMBL20167069 0.93 APLNR (1.00) APLNR
SCHEMBL20167181 0.93 APLNR (1.00) APLNR
SCHEMBL20167066 0.93 APLNR (1.00) APLNR
SCHEMBL20167186 0.93 APLNR (1.00) APLNR
SCHEMBL18246947 0.91 APLNR (1.00) APLNR
SCHEMBL18245757 0.91 APLNR (1.00) APLNR
SCHEMBL21748027 0.91 APLNR (1.00) APLNR
SCHEMBL30727129 0.91 APLNR (1.00) APLNR
SCHEMBL29219021 0.91 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108137545-B Triazole agonists of the APJ receptor 美国安进公司 2020-09-22 CN claimed
CN-108137545-B Triazole agonists of the APJ receptor 美国安进公司 2020-09-22 CN disclosed