SCHEMBL9848779

SCHEMBL9848779

CC(C)(c1ccc(O)cc1)C(Cl)OCc1cccc(Oc2ccccc2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 4/20 0.41
LTA4H P09960 1/20 0.41
NR1H2 P55055 1/20 0.41
BAX Q07812 1/20 0.41
MMP1 P03956 2/20 0.40
CETP P11597 3/20 0.40
MMP2 P08253 1/20 0.40
MMP9 P14780 1/20 0.40
MMP12 P39900 1/20 0.40
FFAR4 Q5NUL3 2/20 0.39
LMNA P02545 1/20 0.39
ADRA2A P08913 1/20 0.39
CNR1 P21554 1/20 0.39
ATM Q13315 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PTGES O14684 1/20 0.39
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
NPC1 O15118 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
SCHEMBL9848777 0.87 FFAR1 (0.48) FFAR1LTA4HCETPFFAR4TDP1
SCHEMBL9339511 0.80 FFAR1 (0.46) FFAR1MMP1CETPMMP2MMP9
SCHEMBL9326504 0.79 PTGES (0.42) FFAR1LTA4HNR1H2BAXCETP
SCHEMBL7524365 0.77 NPC1 (0.46) FFAR1LTA4HNR1H2BAXMMP1
SCHEMBL9848795 0.76 KDM4E (0.42) FFAR1MMP1CETPFFAR4TDP1
SCHEMBL9848766 0.75 FFAR1 (0.47) FFAR1MMP1CETPFFAR4TDP1
SCHEMBL9848769 0.74 FFAR1 (0.39) FFAR1CETPFFAR4TDP1PTGES
SCHEMBL9340177 0.74 PKM (0.45) FFAR1MMP1CETPMMP2MMP9
SCHEMBL9324651 0.72 FDFT1 (0.47) FFAR1LTA4HNR1H2BAXCETP
SCHEMBL10360187 0.72 TDP1 (0.45) FFAR1MMP1CETPFFAR4LMNA

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-0421385-A1 Process for producing p-hydroxyneophyl m-phenoxybenzyl ether MITSUI TOATSU CHEMICALS, Inc. (JP) 1991-04-10 EP disclosed