SCHEMBL6143897

SCHEMBL6143897

CC(C)(C)OC(=O)N1CCCc2ccc(OCCCC3CCCNC3)cc21

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 13/20 0.47
ITGB3 P05106 2/20 0.40
ITGA2B P08514 2/20 0.40
HRH3 Q9Y5N1 2/20 0.40
MAPT P10636 1/20 0.37
TSHR P16473 1/20 0.37
MPO P05164 1/20 0.37

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
SCHEMBL6143807 0.93 GPR119 (0.49) GPR119ITGB3ITGA2BHRH3MPO
SCHEMBL6143471 0.89 GPR119 (0.50) GPR119ITGB3ITGA2B
SCHEMBL6142844 0.81 HTR6 (0.43) GPR119HRH3MAPT
SCHEMBL6142865 0.81 S1PR5 (0.41) GPR119HRH3MAPT
SCHEMBL6143538 0.80 HRH3 (0.65) HRH3MAPTTSHR
SCHEMBL6111308 0.78 HRH3 (0.63) HRH3
SCHEMBL15898288 0.76 CHRM4 (0.46) GPR119HRH3MAPTTSHR
SCHEMBL6143574 0.75 GPR119 (0.44) GPR119ITGB3ITGA2BHRH3
SCHEMBL30802841 0.74 HSD17B10 (0.54) MAPTTSHR
SCHEMBL1734457 0.74 HSD17B10 (0.54) MAPTTSHR

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-1585731-A2 HISTAMINE H3 RECEPTOR ANTAGONISTS, PREPARATON AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2005-10-19 EP disclosed
WO-2004026837-A2 HISTAMINE H3 RECEPTOR ANTAGONISTS, PREPARATON AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2004-04-01 WO disclosed