SCHEMBL4967327

SCHEMBL4967327

N#Cc1ccc(OC2CCN(CC3CCNCC3)CC2)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 4/20 0.47
HRH1 P35367 6/20 0.46
CCR3 P51677 6/20 0.46
KCNH2 Q12809 4/20 0.46
SIGMAR1 Q99720 1/20 0.45
HRH3 Q9Y5N1 4/20 0.43
TRPC6 Q9Y210 1/20 0.43
SLC6A2 P23975 2/20 0.42
SLC6A4 P31645 2/20 0.42
SLC6A3 Q01959 2/20 0.42
SCN1A P35498 1/20 0.42
SCN8A Q9UQD0 1/20 0.42
HTR3A P46098 1/20 0.40

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
SCHEMBL5193030 0.86 HRH1 (0.55) UTS2RHRH1CCR3KCNH2SCN1A
Hydrochloric Acid SCHEMBL5192556 0.85 HRH1 (0.54) UTS2RHRH1CCR3KCNH2SCN1A
SCHEMBL4967049 0.79 HRH1 (0.59) UTS2RHRH1CCR3KCNH2SIGMAR1
SCHEMBL4969078 0.79 HRH1 (0.52) HRH1CCR3KCNH2HRH3
SCHEMBL4237496 0.78 HRH3 (0.56) HRH1CCR3HRH3TRPC6
SCHEMBL180455 0.78 HRH1 (0.59) HRH1CCR3KCNH2
SCHEMBL4969060 0.77 HRH1 (0.54) HRH1CCR3KCNH2
SCHEMBL4155719 0.77 HRH1 (0.71) HRH1CCR3KCNH2
SCHEMBL14110602 0.77 HRH1 (0.71) HRH1CCR3KCNH2
SCHEMBL4969419 0.77 CCR3 (0.55) 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-1620400-B1 piperidinylmethylpiperidine derivatives and their use as chemokine modulators ASTRAZENECA AB (SE) 2012-12-05 EP disclosed
EP-1625114-B1 Piperidine derivatives for the the treatment of chemokine or H1 mediated diseases ASTRAZENECA AB (SE) 2008-08-27 EP disclosed