SCHEMBL28707472

SCHEMBL28707472

CO[C](CCc1ccc(OCc2ccccc2)cc1)OC

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 6/20 0.67
FFAR4 Q5NUL3 2/20 0.67
LTA4H P09960 1/20 0.59
EPHX2 P34913 1/20 0.59
BCHE P06276 5/20 0.57
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
LMNA P02545 1/20 0.56
CYP1A2 P05177 1/20 0.56
PTGS1 P23219 1/20 0.56
SLC6A2 P23975 1/20 0.56
CYP2C19 P33261 1/20 0.56
PTGS2 P35354 1/20 0.56
SLC6A3 Q01959 1/20 0.56
HIF1A Q16665 1/20 0.56
HDAC6 Q9UBN7 1/20 0.56
NPC1 O15118 1/20 0.54
RAB9A P51151 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54

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
SCHEMBL1745247 0.84 FFAR1 (0.72) FFAR1FFAR4LTA4HEPHX2NPC1
SCHEMBL1747136 0.84 FFAR1 (0.72) FFAR1FFAR4LTA4HEPHX2NPC1
SCHEMBL5643545 0.84 ALDH1A1 (0.54) FFAR1LMNAHDAC6NPC1RAB9A
SCHEMBL1745237 0.81 FFAR1 (0.70) FFAR1FFAR4NPC1RAB9ASMN1; SMN2
SCHEMBL14305720 0.81 FFAR1 (0.67) FFAR1FFAR4LTA4HEPHX2NPC1
SCHEMBL11156485 0.81 FFAR1 (0.67) FFAR1FFAR4LTA4HEPHX2NPC1
SCHEMBL5033197 0.81 FFAR1 (0.77) FFAR1FFAR4LTA4HEPHX2PTGS1
Benzyloxyphenylpropanoic Acid SCHEMBL1134648 0.80 FFAR1 (1.00) FFAR1FFAR4
SCHEMBL1744939 0.80 FFAR1 (1.00) FFAR1FFAR4
SCHEMBL1860911 0.79 FFAR1 (0.64) FFAR1FFAR4LTA4HEPHX2BCHE

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
CN-114080390-A Synthesis of coelenterazine 国际纸业公司 2022-02-22 CN disclosed