SCHEMBL5190372

SCHEMBL5190372

O=C(O)c1ccccc1CN1CCC(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 20/20 1.00
CCR3 P51677 20/20 1.00
KCNH2 Q12809 15/20 1.00

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
SCHEMBL5189874 0.90 HRH1 (0.81) HRH1CCR3KCNH2
SCHEMBL5192764 0.88 HRH1 (0.78) HRH1CCR3KCNH2
SCHEMBL5737033 0.86 HRH1 (0.79) HRH1CCR3KCNH2
SCHEMBL4970161 0.86 HRH1 (1.00) HRH1CCR3KCNH2
SCHEMBL4967101 0.85 HRH1 (0.77) HRH1CCR3KCNH2
SCHEMBL3938448 0.85 HRH1 (0.73) HRH1CCR3KCNH2
SCHEMBL3938456 0.85 HRH1 (0.73) HRH1CCR3KCNH2
SCHEMBL5191189 0.83 HRH1 (1.00) HRH1CCR3KCNH2
SCHEMBL5190344 0.83 HRH1 (0.72) HRH1CCR3KCNH2
SCHEMBL18841187 0.83 HRH1 (0.71) HRH1CCR3KCNH2

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-1816123-A1 Intermediates for the production of pharmaceutically active compounds AstraZeneca AB (SE) 2007-08-08 EP disclosed
EP-1546130-B1 PIPERIDINE DERIVATIVES FOR USE IN THE TREATMENT OF CHEMOKINE MEDIATED DISEASE STATES ASTRAZENECA AB (SE) 2007-08-01 EP disclosed