SCHEMBL6568902

SCHEMBL6568902

Cc1cc(Cl)ccc1OC1CCN(C2CCN(C(=O)c3ccc(F)cc3)CC2)CC1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 9/20 0.59
CCR3 P51677 8/20 0.59
L3MBTL1 Q9Y468 2/20 0.54
KDM4E B2RXH2 1/20 0.54
MEN1 O00255 1/20 0.54
ALDH1A1 P00352 1/20 0.54
KMT2A Q03164 1/20 0.54
HRH3 Q9Y5N1 2/20 0.50
HSD11B1 P28845 3/20 0.49
MGLL Q99685 1/20 0.49
KCNH2 Q12809 1/20 0.49
L3MBTL3 Q96JM7 2/20 0.45
MBTD1 Q05BQ5 1/20 0.45
TP53BP1 Q12888 1/20 0.45
L3MBTL4 Q8NA19 1/20 0.45
ADRB2 P07550 1/20 0.45

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
SCHEMBL6567690 0.94 CCR3 (0.63) HRH1CCR3L3MBTL1HRH3HSD11B1
SCHEMBL6569270 0.89 HRH1 (0.58) HRH1CCR3KDM4EMEN1ALDH1A1
SCHEMBL6570409 0.88 CCR3 (0.57) HRH1CCR3L3MBTL1HRH3HSD11B1
SCHEMBL6567607 0.88 CCR3 (0.57) HRH1CCR3L3MBTL1MEN1KMT2A
SCHEMBL5416060 0.82 HRH1 (0.62) HRH1CCR3HRH3KCNH2
SCHEMBL5415039 0.82 HRH1 (0.87) HRH1CCR3KCNH2
SCHEMBL6569244 0.82 HRH1 (0.59) HRH1CCR3L3MBTL1KDM4EALDH1A1
SCHEMBL5405625 0.81 HRH1 (0.78) HRH1CCR3L3MBTL1MEN1KMT2A
Trifluoroacetic Acid SCHEMBL5407013 0.81 HRH1 (0.50) HRH1CCR3KDM4EALDH1A1HRH3
SCHEMBL6568469 0.78 HRH1 (0.71) HRH1CCR3L3MBTL1KDM4EMEN1

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