SCHEMBL6650737

SCHEMBL6650737

Cc1c(Cl)ccc(OC2CCN(C[C@H](O)CNC(=O)C3=C[N]C(=O)c4ccccc43)CC2)c1Cl

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 20/20 0.59
CCR3 P51677 20/20 0.59
KCNH2 Q12809 11/20 0.59
CCR1 P32246 1/20 0.45

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
SCHEMBL6651080 0.80 HRH1 (0.66) HRH1CCR3KCNH2CCR1
SCHEMBL2912611 0.78 HRH1 (0.74) HRH1CCR3KCNH2CCR1
SCHEMBL2919568 0.78 HRH1 (0.81) HRH1CCR3KCNH2CCR1
SCHEMBL1928120 0.78 HRH1 (0.67) HRH1CCR3KCNH2
SCHEMBL1929997 0.77 HRH1 (0.70) HRH1CCR3KCNH2CCR1
SCHEMBL1929992 0.76 HRH1 (0.59) HRH1CCR3KCNH2
SCHEMBL1930131 0.76 HRH1 (0.59) HRH1CCR3KCNH2
SCHEMBL6129272 0.76 HRH1 (0.75) HRH1CCR3KCNH2CCR1
SCHEMBL2922697 0.76 HRH1 (0.75) HRH1CCR3KCNH2CCR1
SCHEMBL2918321 0.75 HRH1 (0.74) HRH1CCR3KCNH2CCR1

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
EP-1478624-A1 CHEMICAL COMPOUNDS AstraZeneca AB (SE) 2004-11-24 EP disclosed
WO-2003068743-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2003-08-21 WO disclosed