SCHEMBL4969650

SCHEMBL4969650

COC(=O)c1cccc(Cl)c1N1CCC(CN2CCC(Oc3ccc(C#N)c(Cl)c3)CC2)CC1

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 17/20 0.53
CCR3 P51677 17/20 0.53
KCNH2 Q12809 15/20 0.53
AR P10275 3/20 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
SCHEMBL4968209 0.91 HRH1 (0.63) HRH1CCR3KCNH2
SCHEMBL4967137 0.89 HRH1 (0.66) HRH1CCR3KCNH2AR
SCHEMBL4969635 0.86 HRH1 (0.56) HRH1CCR3KCNH2AR
SCHEMBL4968548 0.85 HRH1 (0.58) HRH1CCR3KCNH2
SCHEMBL4968661 0.85 HRH1 (0.53) HRH1CCR3KCNH2AR
SCHEMBL4969519 0.84 HRH1 (0.61) HRH1CCR3KCNH2AR
SCHEMBL4966034 0.83 HRH1 (0.54) HRH1CCR3KCNH2AR
SCHEMBL4969433 0.83 HRH1 (0.56) HRH1CCR3KCNH2AR
SCHEMBL4967374 0.81 HRH1 (0.80) HRH1CCR3KCNH2
SCHEMBL4966126 0.79 HRH1 (0.63) HRH1CCR3KCNH2AR

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-1625114-B1 Piperidine derivatives for the the treatment of chemokine or H1 mediated diseases ASTRAZENECA AB (SE) 2008-08-27 EP disclosed