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SCHEMBL9955865

SCHEMBL9955865

CCOC(=O)N1CCc2nc(Nc3cccc(Cl)c3)ncc2C1

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PDGFRB P09619 10/20 0.55
▸ MAOB P27338 2/20 0.55
▸ GRM5 P41594 2/20 0.55
▸ KDR P35968 7/20 0.55
▸ MAPT P10636 2/20 0.53
▸ FYN P06241 1/20 0.51
▸ TP53 P04637 1/20 0.48
▸ SIRT5 Q9NXA8 1/20 0.47
▸ MAOA P21397 1/20 0.47

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
SCHEMBL9954695 0.91 PDGFRB (0.66) PDGFRBMAOBGRM5KDRMAPT
SCHEMBL9955606 0.88 PDGFRB (0.55) PDGFRBMAOBGRM5KDRMAPT
SCHEMBL9954102 0.86 MAOB (0.61) PDGFRBMAOBGRM5KDRMAPT
SCHEMBL9954960 0.86 MAOB (0.54) PDGFRBMAOBGRM5KDRMAPT
SCHEMBL9953995 0.85 MAOB (0.57) PDGFRBMAOBGRM5KDRMAPT
SCHEMBL9955998 0.85 MAOB (0.57) PDGFRBMAOBGRM5KDRMAPT
SCHEMBL9955875 0.83 MAOB (0.61) PDGFRBMAOBGRM5KDRMAPT
SCHEMBL9955054 0.83 MAOB (0.61) PDGFRBMAOBGRM5KDRMAPT
SCHEMBL9955388 0.83 GRM5 (0.58) PDGFRBMAOBGRM5KDRMAPT
SCHEMBL9955716 0.83 GRM5 (0.55) PDGFRBMAOBGRM5KDRMAPT

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-2012085167-A1 METABOTROPIC GLUTAMATE RECEPTOR MODULATORS MERZ PHARMA GMBH & CO. KGAA (DE) 2012-06-28 — — WO disclosed