SCHEMBL6982854

SCHEMBL6982854

CCOC(=O)C1(C2CCCCC2)OCC(c2ccccc2)(c2ccccc2)CO1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.44
OPRM1 P35372 5/20 0.42
OPRD1 P41143 4/20 0.41
OPRK1 P41145 3/20 0.41
SLC22A1 O15245 2/20 0.41
SLC6A4 P31645 1/20 0.41
ADRA1A P35348 1/20 0.41
KCNH2 Q12809 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
MAPT P10636 2/20 0.39
ALDH1A1 P00352 1/20 0.39
POLB P06746 1/20 0.39
GAA P10253 1/20 0.39
ALOX15 P16050 1/20 0.39
RECQL P46063 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
KDM4E B2RXH2 1/20 0.39
TSHR P16473 1/20 0.39
KCNA3 P22001 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
SCHEMBL7815962 0.86 OPRM1 (0.35) L3MBTL1OPRM1OPRD1MAPTALDH1A1
SCHEMBL6978140 0.78 OPRM1 (0.49) L3MBTL1OPRM1OPRD1OPRK1SLC22A1
SCHEMBL6981459 0.74 OPRM1 (0.46) L3MBTL1OPRM1OPRD1OPRK1SLC22A1
SCHEMBL6979724 0.73 OPRM1 (0.45) L3MBTL1OPRM1OPRD1OPRK1SLC22A1
SCHEMBL6974990 0.72 OPRM1 (0.46) L3MBTL1OPRM1OPRD1OPRK1SLC22A1
SCHEMBL6983038 0.72 L3MBTL1 (0.56) L3MBTL1OPRM1OPRD1OPRK1SLC22A1
SCHEMBL6970913 0.72 OPRM1 (0.45) L3MBTL1OPRM1OPRD1OPRK1SLC22A1
SCHEMBL980214 0.71 OPRM1 (0.54) L3MBTL1OPRM1OPRD1OPRK1SLC22A1
SCHEMBL6981106 0.71 APP (0.43) L3MBTL1OPRM1OPRD1OPRK1SLC22A1
SCHEMBL6978402 0.70 OPRM1 (0.41) L3MBTL1OPRM1OPRD1OPRK1SLC22A1

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-1098893-B1 CYCLIC COMPOUNDS USEFUL IN THE TREATMENT OF DYSLIPIDEMIA, ATHEROSCLEROSIS AND DIABETES, PHARMACEUTICAL COMPOSITIONS AND PREPARATION PROCESS MERCK PATENT GMBH (DE) 2003-03-26 EP disclosed