SCHEMBL28877832

SCHEMBL28877832

CNC(=O)c1ccc(-n2c(=O)c3c(CN(C)C)c(-c4ccc(N)cc4)sc3n(Cc3c(F)cccc3F)c2=O)nn1

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 20/20 0.66
KCNH2 Q12809 12/20 0.66

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
SCHEMBL29966914 0.92 GNRHR (0.67) GNRHRKCNH2
SCHEMBL28877750 0.91 GNRHR (0.70) GNRHRKCNH2
SCHEMBL28877808 0.90 GNRHR (0.69) GNRHRKCNH2
SCHEMBL28877844 0.90 GNRHR (0.83) GNRHRKCNH2
SCHEMBL28877924 0.86 GNRHR (0.65) GNRHRKCNH2
SCHEMBL29384672 0.86 GNRHR (0.80) GNRHRKCNH2
SCHEMBL15639971 0.86 GNRHR (0.80) GNRHRKCNH2
Hydrochloric Acid SCHEMBL30174360 0.85 GNRHR (0.79) GNRHRKCNH2
SCHEMBL29165465 0.85 GNRHR (0.63) GNRHRKCNH2
SCHEMBL28877879 0.84 GNRHR (0.67) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115260211-B Thiophene condensed ring derivative, pharmaceutical composition, preparation method and application thereof 长春金赛药业有限责任公司 2024-02-06 CN disclosed
CN-115260211-A Thiophene fused ring containing derivative, pharmaceutical composition, preparation method and application thereof 长春金赛药业有限责任公司 2022-11-01 CN disclosed