SCHEMBL4743351

SCHEMBL4743351

OCCOCCc1ccc(OCc2ccccc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.69
EPHX2 P34913 1/20 0.69
FFAR1 O14842 5/20 0.58
FFAR4 Q5NUL3 1/20 0.58
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
BCHE P06276 3/20 0.53
MAOB P27338 1/20 0.51
CYP4F2 P78329 1/20 0.51
CYP4A11 Q02928 1/20 0.51

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
Benzylphenylether SCHEMBL27363693 0.88 ALDH1A1 (0.61) LTA4HEPHX2FFAR1LMNACYP1A2
SCHEMBL18429764 0.87 LMNA (0.59) LTA4HEPHX2LMNACYP1A2PTGS1
SCHEMBL29045776 0.87 LMNA (0.59) LTA4HEPHX2LMNACYP1A2PTGS1
SCHEMBL10795544 0.85 FOXM1 (0.57) LTA4HEPHX2FFAR1FFAR4LMNA
SCHEMBL5700 0.84 LTA4H (0.80) LTA4HEPHX2FFAR1FFAR4LMNA
Di(Hydroxyethyl)Ether SCHEMBL16085977 0.84 TDP1 (0.58) LTA4HEPHX2FFAR1
SCHEMBL1180141 0.84 TDP1 (0.58) LTA4HEPHX2FFAR1
SCHEMBL3589930 0.83 FFAR1 (0.75) LTA4HEPHX2FFAR1FFAR4
SCHEMBL9451327 0.83 ALDH1A1 (0.69) LTA4HEPHX2LMNACYP1A2PTGS1
SCHEMBL4884524 0.83 LTA4H (0.58) LTA4HEPHX2FFAR1FFAR4LMNA

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
WO-2008096093-A1 OXAZOLE AND THIAZOLE DERIVATIVES AND THEIR USES ARGENTA DISCOVERY LTD. (GB) 2008-08-14 WO disclosed