SCHEMBL7147661

SCHEMBL7147661

Cc1ccc(OCc2ccccc2)c(C(O)c2ccc(O)cc2)n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.42
CYP2C19 P33261 3/20 0.42
CYP1A2 P05177 1/20 0.42
PTGS1 P23219 1/20 0.42
SLC6A2 P23975 1/20 0.42
PTGS2 P35354 1/20 0.42
SLC6A3 Q01959 1/20 0.42
HIF1A Q16665 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
MAPT P10636 4/20 0.42
TDP1 Q9NUW8 3/20 0.41
L3MBTL1 Q9Y468 3/20 0.41
MAPK1 P28482 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
CYP2C9 P11712 1/20 0.40
HTT P42858 3/20 0.40
STAT3 P40763 1/20 0.40
GRM5 P41594 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39

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
SCHEMBL6377672 0.93 MAPT (0.44) LMNACYP2C19MAPTTDP1L3MBTL1
SCHEMBL6377134 0.89 CYP1A2 (0.46) LMNACYP2C19CYP1A2MAPTMAPK1
SCHEMBL3876703 0.75 MAPT (0.44) MAPTTDP1L3MBTL1MAPK1SMN1; SMN2
SCHEMBL16491623 0.73 HTT (0.59) LMNAMAPTTDP1L3MBTL1MAPK1
SCHEMBL23926355 0.72 SLC6A2 (0.38) SLC6A2SLC6A3
SCHEMBL30118946 0.72 SLC6A2 (0.38) SLC6A2SLC6A3
SCHEMBL3869852 0.71 L3MBTL1 (0.49) CYP2C19MAPTTDP1L3MBTL1MAPK1
SCHEMBL16415760 0.70 MEN1 (0.52) LMNAMAPTTDP1L3MBTL1MAPK1
SCHEMBL3943486 0.70 L3MBTL1 (0.51) MAPTTDP1L3MBTL1MAPK1SMN1; SMN2
SCHEMBL11067263 0.70 LTA4H (0.58) MAPTTDP1L3MBTL1MAPK1SMN1; SMN2

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
US-6599917-B1 A squalene-synthesizing enzyme inhibitor, a cholesterol biosynthesis inhibitor and a triglyceride biosynthesis inhibitor EISAI CO., LTD. (JP) 2003-07-29 US disclosed