SCHEMBL30402181

SCHEMBL30402181

CN(C)Cc1c(-c2ccc([N+](=O)[O-])cc2)sc2c1c(=O)n(-c1ccc(OCC3COC3)nc1)c(=O)n2Cc1c(F)cccc1F

nearest known ligand 0.69

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 20/20 0.69
KCNH2 Q12809 3/20 0.48

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
SCHEMBL30402101 0.92 GNRHR (0.70) GNRHRKCNH2
SCHEMBL30402172 0.91 GNRHR (0.63) GNRHRKCNH2
SCHEMBL30401945 0.90 GNRHR (0.64) GNRHRKCNH2
SCHEMBL30401912 0.90 GNRHR (0.65) GNRHRKCNH2
SCHEMBL24333567 0.89 GNRHR (0.63) GNRHRKCNH2
SCHEMBL30461654 0.88 GNRHR (0.75) GNRHRKCNH2
SCHEMBL30402053 0.88 GNRHR (0.64) GNRHRKCNH2
SCHEMBL28503222 0.87 GNRHR (0.74) GNRHRKCNH2
SCHEMBL30461679 0.87 GNRHR (0.74) GNRHRKCNH2
SCHEMBL28491787 0.87 GNRHR (0.75) 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-116096371-A Pyrimidine diketone compound containing saturated oxygen heterocyclic group and application thereof 广东东阳光药业有限公司 2023-05-09 CN disclosed