SCHEMBL6200075

SCHEMBL6200075

COC(CCOc1ccccc1)C(N)=O

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.51
PPARA Q07869 6/20 0.51
PPARD Q03181 5/20 0.51
PARP10 Q53GL7 1/20 0.50
TDP1 Q9NUW8 1/20 0.48
MAPT P10636 1/20 0.47
RAB9A P51151 1/20 0.47
MTNR1A P48039 1/20 0.45
MTNR1B P49286 1/20 0.45
PKM P14618 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
MAPK1 P28482 1/20 0.44
HPGD P15428 1/20 0.43
ALDH1A1 P00352 2/20 0.43
TAAR1 Q96RJ0 1/20 0.43
RECQL P46063 1/20 0.43

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
SCHEMBL4650646 0.87 PPARG (0.61) PPARGPPARAPPARDTDP1MAPT
SCHEMBL28727724 0.81 PPARG (0.49) PPARGPPARAPPARDPARP10TDP1
SCHEMBL353031 0.80 PARP10 (0.53) PPARGPPARAPARP10TDP1MAPT
SCHEMBL4993603 0.78 PPARG (0.46) PPARGPPARAPPARDTDP1MAPT
SCHEMBL5580783 0.77 KMT2A (0.48) PPARGPPARAHPGDALDH1A1
SCHEMBL10652176 0.75 PPARG (0.52) PPARGPPARAPARP10TDP1
SCHEMBL1833133 0.74 LTA4H (0.54) PPARGPPARAPPARDPARP10TDP1
SCHEMBL7428193 0.74 PARP10 (0.50) PPARGPPARAPPARDPARP10TDP1
SCHEMBL1833135 0.74 LTA4H (0.54) PPARGPPARAPPARDPARP10TDP1
SCHEMBL28991809 0.74 PARP10 (0.50) PPARGPPARAPARP10TDP1MAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1506156-A1 METHOD FOR PREPARING 2-ALKOXYPHENOXYETHANAMINES FROM 2-ALKOXYPHENOXYETHYLACETAMIDES MCM PHARMA GMBH (DE) 2005-02-16 EP disclosed
WO-2003095416-A1 METHOD FOR PREPARING 2-ALKOXYPHENOXYETHANAMINES FROM 2-ALKOXYPHENOXYETHYLACETAMIDES MCM PHARMA GMBH (DE) 2003-11-20 WO disclosed