SCHEMBL11565698

SCHEMBL11565698

CCCCCCCCCc1ccc(O)c(C(=NO)c2cc(CCCCCCCCC)ccc2O)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KAT8 Q9H7Z6 2/20 0.66
PPARA Q07869 1/20 0.54
PTGS2 P35354 3/20 0.50
ESR1 P03372 2/20 0.50
ADRA2A P08913 2/20 0.50
ADORA3 P0DMS8 2/20 0.50
TACR2 P21452 2/20 0.50
SLC6A2 P23975 2/20 0.50
SLC6A4 P31645 2/20 0.50
SLC6A3 Q01959 2/20 0.50
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
LMNA P02545 1/20 0.50
SHBG P04278 1/20 0.50
TP53 P04637 1/20 0.50
CYP3A4 P08684 1/20 0.50
HSPD1 P10809 1/20 0.50
ADRB3 P13945 1/20 0.50
HTR2C P28335 1/20 0.50
HSPE1 P61604 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
SCHEMBL31447498 1.00 KAT8 (0.66) KAT8PPARAPTGS2ESR1ADRA2A
SCHEMBL20597302 0.89 KAT8 (0.60) KAT8PPARAIGF1RALOX15MGLL
SCHEMBL28288244 0.89 KAT8 (0.60) KAT8PPARAIGF1RALOX15MGLL
SCHEMBL5897101 0.89 KAT8 (0.60) KAT8PPARAIGF1RALOX15MGLL
SCHEMBL18059943 0.89 KAT8 (0.60) KAT8PPARAIGF1RALOX15MGLL
SCHEMBL28028748 0.89 KAT8 (0.60) KAT8PPARAIGF1RALOX15MGLL
SCHEMBL3834574 0.89 KAT8 (0.60) KAT8PPARAIGF1RALOX15MGLL
SCHEMBL8831210 0.88 KAT8 (0.66) KAT8PPARAPTGS2ESR1ADRA2A
SCHEMBL8831236 0.88 KAT8 (0.66) KAT8PPARAPTGS2ESR1ADRA2A
SCHEMBL9346950 0.86 KAT8 (0.64) KAT8PPARAPTGS2ESR1ADRA2A

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
US-4173616-A COMPLEXING WITH HYDROXY-OXIME COMPOUNDS SHELL OIL COMPANY (US) 1979-11-06 US disclosed