SCHEMBL3948951

SCHEMBL3948951

O=C(O)CCCCOc1cccc(F)c1F

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 2/20 0.49
KDM4E B2RXH2 1/20 0.48
LTB4R Q15722 3/20 0.46
FFAR4 Q5NUL3 2/20 0.46
LTB4R2 Q9NPC1 1/20 0.46
CNR2 P34972 1/20 0.46
PPARA Q07869 2/20 0.45
FABP3 P05413 1/20 0.45
FABP4 P15090 1/20 0.45
LMNA P02545 1/20 0.45
TSHR P16473 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL1007343 0.98 GRM2 (0.48) GRM2KDM4ELTB4RFFAR4LTB4R2
SCHEMBL13506327 0.90 LMNA (0.56) GRM2KDM4EFFAR4LMNAL3MBTL1
SCHEMBL8220579 0.87 KDM4E (0.61) KDM4ELTB4RPPARALMNATDP1
SCHEMBL13492009 0.85 KDM4E (0.60) KDM4ELTB4RLTB4R2PPARALMNA
SCHEMBL1006920 0.85 KDM4E (0.60) KDM4ELTB4RLTB4R2PPARALMNA
SCHEMBL4951982 0.85 FFAR4 (0.45) FFAR4CNR2PPARATSHR
SCHEMBL1009647 0.84 FFAR1 (0.44) LTB4RFFAR4LTB4R2CNR2PPARA
SCHEMBL15676643 0.82 GRM2 (0.43) GRM2KDM4ELTB4RFFAR4PPARA
SCHEMBL28550531 0.81 KDM4E (0.59) KDM4EFFAR4LMNATSHRTDP1
SCHEMBL6002091 0.80 L3MBTL1 (0.47) GRM2KDM4ECNR2TDP1L3MBTL1

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-1275378-B1 Particulate construct comprising polyhydroxyalkanoate and method for producing it CANON KK (JP) 2009-04-15 EP disclosed