SCHEMBL15045017

SCHEMBL15045017

O=C(N[C@H](Cc1c[nH]c2ccccc12)c1nnc(CCc2c[nH]c3ccccc23)n1Cc1cccc2c1CCC=C2)[C@@H]1CCCN1

nearest known ligand 0.67

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ GHSR Q92847 20/20 0.67

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
SCHEMBL4107033 0.87 GHSR (0.75) GHSR
SCHEMBL4117673 0.83 GHSR (0.72) GHSR
SCHEMBL4113453 0.80 GHSR (0.80) GHSR
SCHEMBL20525986 0.80 GHSR (1.00) GHSR
SCHEMBL20525955 0.80 GHSR (1.00) GHSR
SCHEMBL3671928 0.80 GHSR (1.00) GHSR
SCHEMBL3679131 0.80 GHSR (1.00) GHSR
SCHEMBL3671931 0.80 GHSR (1.00) GHSR
SCHEMBL20526017 0.80 GHSR (1.00) GHSR
SCHEMBL3675140 0.80 GHSR (1.00) 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
EP-2604594-A1 1,2,4-Triazole derivatives as ghrelin analogue ligands of GHS receptors Æterna Zentaris GmbH (DE) 2013-06-19 — — EP disclosed
Send feedback