SCHEMBL29660244

SCHEMBL29660244

COc1ccc(-n2c(=O)c3c(CN(C)C)c(-c4ccc(N(OC)C(N)=O)cc4)sc3n(Cc3c(F)cccc3F)c2=O)nn1

nearest known ligand 0.76

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 20/20 0.76
KCNH2 Q12809 14/20 0.76

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
SCHEMBL21293946 1.00 GNRHR (0.76) GNRHRKCNH2
SCHEMBL29660239 1.00 GNRHR (0.76) GNRHRKCNH2
SCHEMBL30991361 0.94 GNRHR (0.72) GNRHRKCNH2
SCHEMBL31671084 0.92 GNRHR (0.78) GNRHRKCNH2
SCHEMBL22654511 0.91 GNRHR (0.81) GNRHRKCNH2
SCHEMBL17092971 0.89 GNRHR (0.74) GNRHRKCNH2
SCHEMBL29384672 0.88 GNRHR (0.80) GNRHRKCNH2
SCHEMBL15639971 0.88 GNRHR (0.80) GNRHRKCNH2
SCHEMBL22654512 0.88 GNRHR (0.73) GNRHRKCNH2
SCHEMBL30568719 0.88 GNRHR (0.73) 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
EP-4009977-A2 COMPOSITIONS AND METHODS FOR THE TREATMENT OF ESTROGEN-DEPENDENT DISORDERS ObsEva S.A. (CH) 2022-06-15 EP disclosed