SCHEMBL4474695

SCHEMBL4474695

c1cc2c(cc1OC1CCN(C3CCC3)CC1)CC1(CCNCC1)[C@H]2CC1CCOCC1

nearest known ligand 0.48

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 20/20 0.48

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
SCHEMBL4478245 0.82 HRH3 (0.48) HRH3
SCHEMBL4479047 0.74 HRH3 (0.46) HRH3
SCHEMBL3776595 0.73 HRH3 (0.62) HRH3
SCHEMBL4485943 0.73 HRH3 (0.45) HRH3
SCHEMBL3776585 0.72 HRH3 (0.52) HRH3
SCHEMBL4564958 0.68 HRH1 (0.50) HRH3
SCHEMBL4481591 0.67 HRH1 (0.42)
SCHEMBL11918729 0.66 HRH3 (1.00) HRH3
SCHEMBL3085867 0.65 HRH3 (1.00) HRH3
SCHEMBL11918570 0.65 HRH3 (1.00) HRH3

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-2009039431-A2 SUBSTITUTED ARYL-FUSED SPIROCYCLIC AMINES NEUROGEN CORPORATION (US) 2009-03-26 WO claimed