SCHEMBL8814946

SCHEMBL8814946

CCOP(=O)(Cc1ccc(OCc2ccccc2)cc1)CC(O)CCl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.44
EPHX2 P34913 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
LMNA P02545 2/20 0.44
ALOX5 P09917 4/20 0.43
PPARG P37231 1/20 0.43
PPARD Q03181 1/20 0.43
PPARA Q07869 1/20 0.43
CHRNA7 P36544 2/20 0.41
CHRNB2 P17787 1/20 0.41
CHRNB4 P30926 1/20 0.41
CHRNA3 P32297 1/20 0.41
CHRNA4 P43681 1/20 0.41
MMP12 P39900 1/20 0.41
MAOB P27338 1/20 0.41
ENPP2 Q13822 1/20 0.41
CYP1A2 P05177 1/20 0.40
PTGS1 P23219 1/20 0.40
SLC6A2 P23975 1/20 0.40
CYP2C19 P33261 1/20 0.40

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
SCHEMBL8976576 0.89 POLB (0.44) CYP2C19
SCHEMBL8751389 0.89 POLB (0.44) CYP2C19
SCHEMBL8815671 0.83 POLB (0.35) EPHX2LMNAENPP2PTGS1SLC6A2
SCHEMBL8011004 0.76 ALOX5 (0.51) LTA4HEPHX2L3MBTL1LMNAALOX5
SCHEMBL1552840 0.73 PPARG (0.58) LTA4HEPHX2L3MBTL1LMNAPPARG
SCHEMBL1552843 0.73 PPARG (0.58) LTA4HEPHX2L3MBTL1LMNAPPARG
SCHEMBL9063192 0.72 MEN1 (0.45) CYP2C19
SCHEMBL9063188 0.72 MEN1 (0.45) CYP2C19
SCHEMBL10624880 0.72 ALOX5 (0.60) LTA4HEPHX2L3MBTL1LMNAALOX5
SCHEMBL7296695 0.72 RAB9A (0.59) LTA4HEPHX2L3MBTL1LMNACHRNA7

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-1997011953-A1 NOVEL HYDROXYLATED AND ALKOXYLATED N- AND/OR P-ARALKYLPHOSPHINIC ACID DERIVATIVES NOVARTIS AG (CH) 1997-04-03 WO disclosed