SCHEMBL6964254

SCHEMBL6964254

Clc1ccc(Cn2cc(CN3CCC(c4ccccc4)(c4ccccc4)CC3)nn2)cc1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 1/20 0.57
NOTUM Q6P988 1/20 0.51
CYP19A1 P11511 2/20 0.50
ACHE P22303 2/20 0.46
CCR3 P51677 1/20 0.45
SIGMAR1 Q99720 1/20 0.44
HSP90AB1 P08238 2/20 0.44
MGAM O43451 1/20 0.43
GAA P10253 1/20 0.43
SI P14410 1/20 0.43
MGAM2 Q2M2H8 1/20 0.43

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
SCHEMBL6976116 0.82 CCR3 (0.46) CCR3SIGMAR1
SCHEMBL11743900 0.82 SIGMAR1 (0.66) CCR3SIGMAR1
Hydrochloric Acid SCHEMBL6971416 0.81 CCR3 (0.45) CCR3SIGMAR1
SCHEMBL6969018 0.79 CCR3 (0.45) CCR3SIGMAR1
Hydrochloric Acid SCHEMBL6979143 0.78 CCR3 (0.44) CCR3SIGMAR1
SCHEMBL6976709 0.76 CCR3 (0.45) CCR3SIGMAR1
SCHEMBL6969667 0.76 CCR3 (0.43) CCR3SIGMAR1
Hydrochloric Acid SCHEMBL6978470 0.75 CCR3 (0.42) CCR3SIGMAR1GAA
SCHEMBL6968225 0.75 SMN1; SMN2 (0.42) CCR3SIGMAR1
SCHEMBL6967295 0.75 CCR3 (0.42) CCR3SIGMAR1

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