SCHEMBL4967102

SCHEMBL4967102

O=C(O)c1ccccc1N1CCC(O)(CN2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1

nearest known ligand 0.72

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ HRH1 P35367 18/20 0.72
▸ CCR3 P51677 18/20 0.72
▸ KCNH2 Q12809 15/20 0.72
▸ FFAR4 Q5NUL3 2/20 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
SCHEMBL4966177 0.90 CCR3 (0.59) HRH1CCR3KCNH2FFAR4
SCHEMBL4970161 0.84 HRH1 (1.00) HRH1CCR3KCNH2
SCHEMBL5190405 0.81 HRH1 (0.51) HRH1CCR3KCNH2FFAR4
SCHEMBL5191328 0.80 HRH1 (0.72) HRH1CCR3KCNH2
SCHEMBL4967162 0.78 HRH1 (0.85) HRH1CCR3KCNH2
SCHEMBL3938665 0.78 HRH1 (0.71) HRH1CCR3KCNH2
SCHEMBL3938673 0.78 HRH1 (0.71) HRH1CCR3KCNH2
SCHEMBL5194646 0.77 CCR3 (0.47) HRH1CCR3KCNH2
SCHEMBL5190427 0.77 CCR3 (0.49) HRH1CCR3KCNH2
SCHEMBL5191295 0.77 CCR3 (0.47) 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 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
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