SCHEMBL13693854

SCHEMBL13693854

COc1ccc(Cn2c(CCc3ccccc3)nnc2[C@@H](C)NC(=O)CN)cc1

nearest known ligand 0.66

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ GHSR Q92847 20/20 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
SCHEMBL2742698 0.80 GHSR (1.00) GHSR
SCHEMBL5604252 0.80 GHSR (1.00) GHSR
SCHEMBL3675804 0.74 GHSR (0.90) GHSR
SCHEMBL3682883 0.74 GHSR (0.91) GHSR
SCHEMBL14418680 0.74 GHSR (0.91) GHSR
SCHEMBL4108108 0.74 GHSR (0.71) GHSR
SCHEMBL4101979 0.73 GHSR (0.71) GHSR
SCHEMBL3674682 0.73 GHSR (0.82) GHSR
SCHEMBL3674679 0.73 GHSR (0.82) GHSR
SCHEMBL20525944 0.73 GHSR (0.82) GHSR

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
WO-2009115503-A1 NOVEL 1,2,4-TRIAZOLE DERIVATIVES AND PROCESS OF MANUFACTURING THEREOF ÆTERNA ZENTARIS GMBH (DE) 2009-09-24 — — WO disclosed
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