SCHEMBL8213684

SCHEMBL8213684

COc1cc2cc(C3CC3C(=O)C34CC5CCCC(C3)C(C5)C4)cnc2cc1OC

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 16/20 0.46
PDGFRA P16234 16/20 0.46
GRM1 Q13255 1/20 0.36

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
SCHEMBL8215082 0.87 HPGDS (0.42)
SCHEMBL8212845 0.87 ALDH1A1 (0.42) PDGFRBPDGFRAGRM1
SCHEMBL4729407 0.87 PDGFRB (0.48) PDGFRBPDGFRAGRM1
SCHEMBL8211978 0.84 GRM1 (0.40) GRM1
SCHEMBL8215059 0.83 GRM1 (0.40) GRM1
SCHEMBL8215665 0.79 RXRA (0.36) GRM1
SCHEMBL4729426 0.73 ALDH1A1 (0.49) PDGFRBPDGFRAGRM1
SCHEMBL4728861 0.73 HPGDS (0.46) GRM1
SCHEMBL8215134 0.73 ITK (0.35) GRM1
SCHEMBL8219547 0.71 CNR2 (0.35) GRM1

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-2008035049-A1 ADAMANTANYL-(CYCLOPROPYL)-KETONES AS METABOTROPIC GLUTAMATE RECEPTOR MODULATORS MERZ PHARMA GMBH & CO. KGAA (DE) 2008-03-27 WO disclosed