SCHEMBL8027907

SCHEMBL8027907

NC(Cc1ccc(OCc2ccccc2)cc1)[PH](=O)O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 5/20 0.58
LAP3 P28838 1/20 0.58
PPARG P37231 3/20 0.55
PPARA Q07869 3/20 0.55
FFAR1 O14842 1/20 0.54
FFAR4 Q5NUL3 1/20 0.54
LMNA P02545 1/20 0.51
CYP1A2 P05177 1/20 0.51
PTGS1 P23219 1/20 0.51
SLC6A2 P23975 1/20 0.51
CYP2C19 P33261 1/20 0.51
PTGS2 P35354 1/20 0.51
SLC6A3 Q01959 1/20 0.51
HIF1A Q16665 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
MAOB P27338 3/20 0.51
PARP10 Q53GL7 1/20 0.51
NR4A1 P22736 1/20 0.50
NR4A2 P43354 1/20 0.50
NR4A3 Q92570 1/20 0.50

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
SCHEMBL16836842 0.84 ALPI (0.53) LAP3CYP1A2PTGS1SLC6A2SLC6A3
SCHEMBL3862224 0.84 ALPI (0.53) LAP3CYP1A2PTGS1SLC6A2SLC6A3
Bromide SCHEMBL6929745 0.82 ALPI (0.52) LAP3CYP1A2PTGS1SLC6A2SLC6A3
SCHEMBL288912 0.79 SLC7A5 (0.69) LTA4HLAP3PPARGPPARAFFAR1
SCHEMBL659105 0.79 SLC7A5 (0.69) LTA4HLAP3PPARGPPARAFFAR1
SCHEMBL515522 0.79 SLC7A5 (0.69) LTA4HLAP3PPARGPPARAFFAR1
SCHEMBL2032141 0.78 LTA4H (0.74) LTA4HLAP3PPARGPPARAFFAR1
SCHEMBL4701244 0.78 LTA4H (0.74) LTA4HLAP3PPARGPPARAFFAR1
SCHEMBL5358938 0.78 LTA4H (0.74) LTA4HLAP3PPARGPPARAFFAR1
SCHEMBL2027392 0.78 LTA4H (0.74) LTA4HLAP3PPARGPPARAFFAR1

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-0767794-B1 PHOSPHINIC ACID DERIVATIVES SCHERING CORP (US) 2000-02-02 EP disclosed