SCHEMBL30461564

SCHEMBL30461564

CN(C)Cc1c(-c2ccc(N)cc2)sc2c1c(=O)n(-c1cccc(OCCF)n1)c(=O)n2Cc1c(F)cccc1F

nearest known ligand 0.59

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 20/20 0.59
KCNH2 Q12809 12/20 0.57

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
SCHEMBL30461599 0.90 GNRHR (0.68) GNRHRKCNH2
SCHEMBL30461590 0.90 GNRHR (0.70) GNRHRKCNH2
SCHEMBL28492652 0.90 GNRHR (0.60) GNRHRKCNH2
SCHEMBL28979559 0.88 GNRHR (0.77) GNRHRKCNH2
SCHEMBL30461666 0.87 GNRHR (0.58) GNRHRKCNH2
SCHEMBL30461648 0.87 GNRHR (0.68) GNRHRKCNH2
SCHEMBL30402745 0.87 GNRHR (0.56) GNRHRKCNH2
SCHEMBL29519173 0.85 GNRHR (0.56) GNRHRKCNH2
SCHEMBL29492152 0.85 GNRHR (0.60) GNRHRKCNH2
SCHEMBL30486939 0.84 GNRHR (0.61) 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