SCHEMBL5266154

SCHEMBL5266154

[O]C1CCN(C2CCCC(F)CC2)CC1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 6/20 0.36
L3MBTL3 Q96JM7 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
OPRM1 P35372 2/20 0.32
OPRL1 P41146 2/20 0.32
ABCB1 P08183 1/20 0.32
SLC18A3 Q16572 1/20 0.32
OPRK1 P41145 1/20 0.31
SIGMAR1 Q99720 1/20 0.30
POLB P06746 1/20 0.30
HSD17B10 Q99714 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL2115182 0.96 SLC18A3 (0.35) HRH3L3MBTL3L3MBTL1OPRM1OPRL1
SCHEMBL2117622 0.96 HRH3 (0.38) HRH3L3MBTL3L3MBTL1OPRM1OPRL1
SCHEMBL2115687 0.91 HRH3 (0.35) HRH3L3MBTL3L3MBTL1
SCHEMBL1814912 0.84 SLC18A3 (0.39) L3MBTL3L3MBTL1OPRM1OPRL1SLC18A3
SCHEMBL2113705 0.83 HRH3 (0.31) HRH3L3MBTL3L3MBTL1
SCHEMBL5266158 0.82 HRH3 (0.35) HRH3L3MBTL3L3MBTL1OPRM1ABCB1
SCHEMBL16387906 0.80 HRH3 (0.41) HRH3L3MBTL3L3MBTL1ABCB1SLC18A3
SCHEMBL1828751 0.79 SLC18A3 (0.43) HRH3L3MBTL3L3MBTL1OPRM1OPRL1
SCHEMBL2115192 0.79 OPRM1 (0.32) L3MBTL3L3MBTL1OPRM1OPRL1SLC18A3
SCHEMBL29750851 0.79 HRH3 (0.36) HRH3L3MBTL3L3MBTL1ABCB1SLC18A3

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-1820797-A1 SUBSTITUTED PYRIDONE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-08-22 EP disclosed