SCHEMBL9629030

SCHEMBL9629030

CCCCCCCCCCC(COc1ccc(O)cc1)Oc1ccc(O)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.58
LTA4H P09960 4/20 0.51
PLA2G2A P14555 2/20 0.43
SLC2A1 P11166 1/20 0.42
PLA2G4B P0C869 1/20 0.42
CTRC Q99895 1/20 0.41
SLC6A2 P23975 3/20 0.41
ESR1 P03372 3/20 0.41
ADRA2A P08913 2/20 0.41
ADORA3 P0DMS8 2/20 0.41
TACR2 P21452 2/20 0.41
SLC6A4 P31645 2/20 0.41
SLC6A3 Q01959 2/20 0.41
PTGS1 P23219 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
SHBG P04278 1/20 0.41
TP53 P04637 1/20 0.41
CYP3A4 P08684 1/20 0.41

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
SCHEMBL9629026 1.00 NR5A1 (0.58) NR5A1LTA4HPLA2G2ASLC2A1PLA2G4B
SCHEMBL7777459 0.89 NR5A1 (0.58) NR5A1LTA4HSLC2A1SLC6A2ESR1
SCHEMBL7785538 0.89 NR5A1 (0.58) NR5A1LTA4HSLC2A1SLC6A2ESR1
SCHEMBL7785543 0.89 NR5A1 (0.58) NR5A1LTA4HSLC2A1SLC6A2ESR1
SCHEMBL7784172 0.89 NR5A1 (0.58) NR5A1LTA4HSLC2A1SLC6A2ESR1
SCHEMBL27474720 0.87 NR5A1 (0.56) NR5A1LTA4HSLC2A1SLC6A2ESR1
SCHEMBL27974042 0.86 NR5A1 (0.54) NR5A1LTA4HSLC2A1SLC6A2ESR1
SCHEMBL31268593 0.85 SLC2A1 (0.46) NR5A1PLA2G2ASLC2A1PLA2G4BKDM4E
SCHEMBL13153850 0.85 SLC2A1 (0.46) NR5A1PLA2G2ASLC2A1PLA2G4BKDM4E
SCHEMBL13153855 0.85 SLC2A1 (0.46) NR5A1PLA2G2ASLC2A1PLA2G4BKDM4E

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-0483352-A1 ADVANCED AND UNADVANCED EPOXY RESIN COMPOSITIONS, NUCLEOPHILIC DERIVATIVES THEREOF AND CURABLE AND COATING COMPOSITIONS THEREOF THE DOW CHEMICAL COMPANY (US) 1992-05-06 EP disclosed