SCHEMBL8325686

SCHEMBL8325686

COC(=O)c1ccc(CCCc2c(O)cccc2OCc2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.58
RAB9A P51151 3/20 0.58
MAPT P10636 2/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
PTGER1 P34995 1/20 0.54
PTGER4 P35408 1/20 0.54
PTGER3 P43115 1/20 0.54
PTGER2 P43116 1/20 0.54
HPGD P15428 2/20 0.52
CYP4A11 Q02928 2/20 0.48
RXRA P19793 2/20 0.47
RXRB P28702 1/20 0.47
RXRG P48443 1/20 0.47
CYP4F2 P78329 1/20 0.47
KMT2A Q03164 5/20 0.47
MEN1 O00255 3/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
GAA P10253 2/20 0.46
NPC1 O15118 2/20 0.46
ALDH1A1 P00352 2/20 0.46

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
SCHEMBL8318954 0.93 LMNA (0.63) LMNARAB9AMAPTL3MBTL1PTGER1
SCHEMBL8324027 0.90 MAPT (0.59) LMNARAB9AMAPTL3MBTL1PTGER1
SCHEMBL9176869 0.86 MAPT (0.57) LMNARAB9AMAPTL3MBTL1HPGD
SCHEMBL8322752 0.86 CYP4A11 (0.55) LMNARAB9AMAPTL3MBTL1HPGD
SCHEMBL8977828 0.84 MAPT (0.57) LMNARAB9AMAPTL3MBTL1HPGD
SCHEMBL8322717 0.83 PTGER1 (0.77) LMNARAB9AMAPTL3MBTL1PTGER1
SCHEMBL9064386 0.81 PTGER1 (0.73) LMNARAB9AMAPTL3MBTL1PTGER1
SCHEMBL8327569 0.81 PTGER1 (0.73) LMNARAB9AMAPTL3MBTL1PTGER1
SCHEMBL9064881 0.80 PTGER1 (0.76) MAPTPTGER1PTGER4PTGER3PTGER2
SCHEMBL8674880 0.80 TDP1 (0.50) LMNAL3MBTL1PTGER1PTGER4PTGER3

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-0733033-B1 PHARMACEUTICALLY ACTIVE SUBSTITUTED AROMATIC COMPOUNDS ZENECA LTD (GB) 1999-12-22 EP disclosed
EP-0733033-A1 PHARMACEUTICALLY ACTIVE SUBSTITUTED AROMATIC COMPOUNDS ZENECA LIMITED (GB) 1996-09-25 EP disclosed