SCHEMBL7601251

SCHEMBL7601251

Clc1ccc(OC2CCN(CCCNc3ccnc(NC4CC4)n3)CC2)cc1Cl

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 4/20 0.54
CCR3 P51677 4/20 0.47
ACHE P22303 11/20 0.45
BACE1 P56817 8/20 0.45
KCNH2 Q12809 1/20 0.39
KDM4E B2RXH2 1/20 0.39
FPR2 P25090 1/20 0.38
PROKR1 Q8TCW9 1/20 0.38
MAPK10 P53779 1/20 0.38
MERTK Q12866 1/20 0.38

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
SCHEMBL7596980 0.94 HRH1 (0.47) HRH1CCR3ACHEBACE1KCNH2
SCHEMBL6397083 0.88 HRH1 (0.53) HRH1CCR3KCNH2KDM4EFPR2
SCHEMBL6396292 0.88 HRH1 (0.53) HRH1CCR3KCNH2KDM4EFPR2
SCHEMBL6401984 0.84 HRH1 (0.56) HRH1CCR3KCNH2KDM4EFPR2
SCHEMBL6398061 0.83 HRH1 (0.62) HRH1CCR3KCNH2KDM4E
SCHEMBL6394743 0.83 CCR3 (0.47) HRH1CCR3KCNH2KDM4EFPR2
SCHEMBL6399953 0.82 HRH1 (0.54) HRH1CCR3KCNH2KDM4EFPR2
SCHEMBL6402649 0.81 HRH1 (0.59) HRH1CCR3KCNH2KDM4E
SCHEMBL6395690 0.81 HRH1 (0.59) HRH1CCR3KCNH2FPR2PROKR1
SCHEMBL6399962 0.80 HRH1 (0.52) HRH1CCR3KCNH2KDM4EFPR2

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-1165545-A1 NOVEL COMPOUNDS AstraZeneca AB (SE) 2002-01-02 EP disclosed
WO-2000058305-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2000-10-05 WO disclosed