SCHEMBL1114728

SCHEMBL1114728

CCC(C)[C@@H](C(N)=O)N(C(=O)O)C(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32

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
SCHEMBL1114724 1.00 CA1 (0.32) CA1CA2
SCHEMBL1114726 1.00 CA1 (0.32) CA1CA2
SCHEMBL2138253 0.86
SCHEMBL1114270 0.86
SCHEMBL1114268 0.86
SCHEMBL2499551 0.81 PDF (0.30)
SCHEMBL19719564 0.76 CA1 (0.33) CA1CA2
SCHEMBL20480142 0.76 CA1 (0.35) CA1CA2
SCHEMBL20479564 0.76 CA1 (0.35) CA1CA2
SCHEMBL2699168 0.76 CA1 (0.35) CA1CA2

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
US-8148546-B2 Tetrahydrocarbazole derivatives as ligands of G-protein coupled receptors AETERNA ZENTARIS GMBH (DE) 2012-04-03 US disclosed
EP-2278964-A1 USE OF LHRH ANTAGONISTS AT NON-CASTRATING DOSES Æterna Zentaris GmbH (DE) 2011-02-02 EP disclosed