SCHEMBL6652474

SCHEMBL6652474

CS(=O)(=O)NC[C@H](O)CN1CCC(Oc2ccc(Cl)c(Cl)c2)CC1

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 20/20 0.67
CCR3 P51677 20/20 0.67
KCNH2 Q12809 13/20 0.59
CCR1 P32246 1/20 0.56

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
SCHEMBL3282840 0.90 HRH1 (0.64) HRH1CCR3KCNH2CCR1
SCHEMBL3282833 0.90 HRH1 (0.64) HRH1CCR3KCNH2CCR1
SCHEMBL3284215 0.88 HRH1 (0.70) HRH1CCR3KCNH2CCR1
SCHEMBL3284211 0.88 HRH1 (0.70) HRH1CCR3KCNH2CCR1
SCHEMBL3282503 0.88 HRH1 (0.62) HRH1CCR3KCNH2CCR1
SCHEMBL3282510 0.88 HRH1 (0.62) HRH1CCR3KCNH2CCR1
SCHEMBL3289732 0.86 HRH1 (0.70) HRH1CCR3KCNH2
SCHEMBL3289737 0.86 HRH1 (0.70) HRH1CCR3KCNH2
SCHEMBL3283471 0.86 HRH1 (0.78) HRH1CCR3KCNH2CCR1
SCHEMBL3283473 0.86 HRH1 (0.78) 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