SCHEMBL6568469

SCHEMBL6568469

O=C(c1ccc(F)cc1)N1CCC(N2CCC(Oc3ccc(Cl)c(Cl)c3)CC2)CC1

nearest known ligand 0.71

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 18/20 0.71
CCR3 P51677 18/20 0.71
HRH3 Q9Y5N1 1/20 0.57
KCNH2 Q12809 4/20 0.57
KDM4E B2RXH2 1/20 0.57
MEN1 O00255 1/20 0.57
ALDH1A1 P00352 1/20 0.57
KMT2A Q03164 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57

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
SCHEMBL6570642 0.91 HRH1 (0.80) HRH1CCR3HRH3KCNH2
SCHEMBL6568370 0.89 HRH1 (0.71) HRH1CCR3HRH3KCNH2
SCHEMBL5411458 0.89 HRH1 (0.84) HRH1CCR3KCNH2MEN1KMT2A
SCHEMBL18841156 0.84 CCR3 (0.67) HRH1CCR3HRH3KCNH2
SCHEMBL5410262 0.83 CCR3 (0.81) HRH1CCR3KCNH2MEN1KMT2A
SCHEMBL18841195 0.83 HRH1 (1.00) HRH1CCR3KCNH2MEN1KMT2A
SCHEMBL4718927 0.83 HRH1 (0.72) HRH1CCR3KCNH2
SCHEMBL5412839 0.82 HRH1 (0.68) HRH1CCR3KCNH2
SCHEMBL18841186 0.82 HRH1 (1.00) HRH1CCR3HRH3KCNH2
SCHEMBL5419482 0.81 HRH1 (1.00) 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-1404667-A1 PIPERIDINE DERIVATIVES USEFUL AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY AstraZeneca AB (SE) 2004-04-07 EP disclosed
WO-2003004487-A1 PIPERIDINE DERIVATIVES USEFUL AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY ASTRAZENECA AB (SE) 2003-01-16 WO disclosed