SCHEMBL6967295

SCHEMBL6967295

Clc1ccc(Cn2cc(CN3CCC3)c(CN3CCC(c4ccccc4)(c4ccccc4)CC3)n2)cc1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 1/20 0.42
SIGMAR1 Q99720 5/20 0.41
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 1/20 0.39
DRD4 P21917 5/20 0.38
DRD2 P14416 4/20 0.38
DRD3 P35462 4/20 0.38
OPRL1 P41146 2/20 0.37
C5AR1 P21730 1/20 0.37
SSTR5 P35346 2/20 0.37
POLB P06746 1/20 0.36

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
SCHEMBL6969244 0.93 CHKA (0.45) SIGMAR1KDM4EALDH1A1DRD4DRD2
SCHEMBL6976709 0.90 CCR3 (0.45) CCR3SIGMAR1KDM4EDRD4DRD2
SCHEMBL6973584 0.90 SIGMAR1 (0.40) CCR3SIGMAR1KDM4EALDH1A1DRD4
SCHEMBL6977411 0.89 CCR3 (0.41) CCR3SIGMAR1KDM4EALDH1A1DRD4
SCHEMBL6975673 0.86 CYP2D6 (0.45) CCR3KDM4EALDH1A1DRD4DRD2
SCHEMBL6967508 0.85 DPP7 (0.41) CCR3SIGMAR1KDM4EALDH1A1C5AR1
SCHEMBL6976705 0.85 CHRM4 (0.42) CCR3ALDH1A1
SCHEMBL6967328 0.84 CCR3 (0.36) CCR3SIGMAR1ALDH1A1DRD4DRD2
SCHEMBL6968225 0.83 SMN1; SMN2 (0.42) CCR3SIGMAR1ALDH1A1DRD4DRD2
SCHEMBL6968412 0.82 OPRL1 (0.39) CCR3SIGMAR1DRD4DRD2DRD3

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6566376-B1 For therapy of chemokine receptor related diseases and conditions such as rheumatoid arthritis, chronic obstructive pulmonary disease ASTRAZENECA UK LIMITED (GB) 2003-05-20 US claimed
EP-1202984-B1 DIPHENYL-PIPERIDINE DERIVATE ASTRAZENECA UK LTD (GB) 2003-03-05 EP claimed
US-6566376-B1 For therapy of chemokine receptor related diseases and conditions such as rheumatoid arthritis, chronic obstructive pulmonary disease ASTRAZENECA UK LIMITED (GB) 2003-05-20 US disclosed
EP-1202984-B1 DIPHENYL-PIPERIDINE DERIVATE ASTRAZENECA UK LTD (GB) 2003-03-05 EP disclosed
EP-1202984-A1 NOVEL DIPHENYL-PIPERIDINE DERIVATE AstraZeneca UK Limited (GB) 2002-05-08 EP disclosed
WO-2001005782-A1 NOVEL DIPHENYL-PIPERIDINE DERIVATE ASTRAZENECA UK LIMITED (GB) 2001-01-25 WO disclosed