SCHEMBL3377635

SCHEMBL3377635

Cc1cc(OC(=O)N(C)CC2CC(Oc3ccc(CN4CCCC4)c(Cl)c3)C2)nn1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.48
SIGMAR1 Q99720 1/20 0.35
KCNH2 Q12809 3/20 0.34
HRH1 P35367 2/20 0.34
CCR3 P51677 2/20 0.34
POLB P06746 2/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CHKA P35790 1/20 0.34
LSS P48449 1/20 0.34
MLNR O43193 1/20 0.33
PLA2G1B P04054 1/20 0.33
ATG4B Q9Y4P1 1/20 0.33
FPR2 P25090 1/20 0.33
PROKR1 Q8TCW9 1/20 0.33
OPRM1 P35372 1/20 0.33
OPRD1 P41143 1/20 0.33
OPRK1 P41145 1/20 0.33
EPHX2 P34913 1/20 0.33

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
SCHEMBL3381646 0.86 HRH3 (0.49) HRH3KCNH2HRH1CCR3POLB
SCHEMBL3380675 0.85 HRH3 (0.48) HRH3KCNH2HRH1CCR3POLB
SCHEMBL3380203 0.85 HRH3 (0.48) HRH3KCNH2HRH1CCR3POLB
SCHEMBL3375675 0.85 HRH3 (0.49) HRH3KCNH2HRH1CCR3POLB
SCHEMBL3380081 0.84 HRH3 (0.47) HRH3KCNH2HRH1CCR3POLB
SCHEMBL3377866 0.84 HRH3 (0.48) HRH3KCNH2HRH1CCR3POLB
SCHEMBL3414223 0.84 HRH3 (0.48) HRH3KCNH2HRH1CCR3POLB
SCHEMBL3378194 0.83 HRH3 (0.47) HRH3KCNH2HRH1CCR3POLB
SCHEMBL3380776 0.83 HRH3 (0.47) HRH3KCNH2HRH1CCR3POLB
SCHEMBL3377526 0.83 HRH3 (0.47) HRH3KCNH2HRH1CCR3LSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1899296-B1 HISTAMINE-3 RECEPTOR ANTAGONISTS PFIZER PROD INC (US) 2010-11-17 EP claimed