SCHEMBL13693722

SCHEMBL13693722

O=C(N[C@H](Cc1c[nH]c2ccccc12)c1nnc(CC2=CCCC=C2)n1Cc1ccc(Cl)c(Cl)c1)c1cnccn1

nearest known ligand 0.55

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ GHSR Q92847 20/20 0.55

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
SCHEMBL13693721 0.94 GHSR (0.60) GHSR
SCHEMBL4113302 0.89 GHSR (0.63) GHSR
SCHEMBL13693719 0.86 GHSR (0.55) GHSR
SCHEMBL13693723 0.85 GHSR (0.66) GHSR
SCHEMBL13693720 0.84 GHSR (0.58) GHSR
SCHEMBL13693718 0.84 GHSR (0.62) GHSR
SCHEMBL4106575 0.83 GHSR (0.69) GHSR
SCHEMBL13695047 0.78 GHSR (0.69) GHSR
SCHEMBL13693776 0.77 GHSR (0.39) GHSR
SCHEMBL3637804 0.77 GHSR (0.77) 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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