SCHEMBL28979561

SCHEMBL28979561

CONC(=O)Nc1ccc(-c2sc3c(c2CN(C)C)c(=O)n(-c2ccc(OCCF)nn2)c(=O)n3Cc2c(F)cccc2F)cc1

nearest known ligand 0.89

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 20/20 0.89
KCNH2 Q12809 12/20 0.89

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
SCHEMBL30461683 1.00 GNRHR (0.89) GNRHRKCNH2
Relugolix SCHEMBL29386968 0.94 GNRHR (1.00) GNRHRKCNH2
Relugolix SCHEMBL778416 0.94 GNRHR (1.00) GNRHRKCNH2
SCHEMBL20742023 0.93 GNRHR (1.00) GNRHRKCNH2
SCHEMBL28979559 0.92 GNRHR (0.77) GNRHRKCNH2
SCHEMBL30461659 0.92 GNRHR (0.87) GNRHRKCNH2
SCHEMBL28979585 0.92 GNRHR (1.00) GNRHRKCNH2
SCHEMBL28979571 0.92 GNRHR (0.87) GNRHRKCNH2
SCHEMBL28979541 0.90 GNRHR (0.89) GNRHRKCNH2
SCHEMBL28979579 0.90 GNRHR (0.76) GNRHRKCNH2

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
CN-113754679-B Substituted pyrimidinediones and their use 广东东阳光药业有限公司 2023-04-07 CN disclosed