SCHEMBL7148154

SCHEMBL7148154

CS(=O)(=O)c1cccc(C(=O)N2CCC(N3CCC(Oc4ccc(Cl)c(Cl)c4)CC3=O)CC2)c1

nearest known ligand 0.77

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 18/20 0.77
CCR3 P51677 18/20 0.77
HRH3 Q9Y5N1 1/20 0.50
KCNH2 Q12809 5/20 0.48
EPHX2 P34913 1/20 0.44

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
SCHEMBL5409041 0.87 HRH1 (1.00) HRH1CCR3HRH3KCNH2
Acetic Acid SCHEMBL4718930 0.84 HRH1 (0.95) HRH1CCR3HRH3KCNH2
SCHEMBL1809105 0.79 HRH1 (0.72) HRH1CCR3HRH3EPHX2
SCHEMBL5405103 0.79 HRH1 (0.72) HRH1CCR3HRH3KCNH2EPHX2
SCHEMBL1811381 0.78 HRH1 (0.71) HRH1CCR3HRH3EPHX2
SCHEMBL18841184 0.77 HRH1 (1.00) HRH1CCR3HRH3KCNH2EPHX2
SCHEMBL5410262 0.74 CCR3 (0.81) HRH1CCR3KCNH2
SCHEMBL5398675 0.74 HRH1 (0.76) HRH1CCR3KCNH2
SCHEMBL5349196 0.74 CCR3 (0.65) HRH1CCR3HRH3KCNH2EPHX2
SCHEMBL5345571 0.74 CCR3 (0.65) HRH1CCR3HRH3KCNH2EPHX2

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-1274701-A1 CHEMICAL COMPOUNDS AstraZeneca AB (SE) 2003-01-15 EP disclosed
WO-2001077101-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2001-10-18 WO disclosed