SCHEMBL9826953

SCHEMBL9826953

O=CNc1ccc(CCc2ccc(OCc3ccccc3)c(OCc3ccccc3)c2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.54
POLB P06746 1/20 0.47
MAPT P10636 1/20 0.47
THRB P10828 1/20 0.47
BCHE P06276 2/20 0.47
SMN1; SMN2 Q16637 3/20 0.46
MTNR1A P48039 2/20 0.46
MTNR1B P49286 2/20 0.46
KDM4E B2RXH2 2/20 0.46
LMNA P02545 2/20 0.46
HTT P42858 2/20 0.46
ALDH1A1 P00352 1/20 0.46
KMT2A Q03164 4/20 0.46
MEN1 O00255 3/20 0.46
GAA P10253 1/20 0.46
C5AR1 P21730 3/20 0.46
ATM Q13315 1/20 0.45
HDAC1 Q13547 1/20 0.45
HDAC2 Q92769 1/20 0.45
NPY1R P25929 1/20 0.44

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
SCHEMBL9828064 0.82 SLC2A1 (0.54) SLC2A1POLBMAPTTHRBBCHE
SCHEMBL21473721 0.81 SLC2A1 (0.60) SLC2A1BCHESMN1; SMN2MTNR1AMTNR1B
SCHEMBL10826834 0.79 SLC2A1 (0.53) SLC2A1MAPTBCHESMN1; SMN2MTNR1A
SCHEMBL9826817 0.77 MAOB (0.58) SLC2A1MAPTSMN1; SMN2KDM4EKMT2A
SCHEMBL4673711 0.76 BCHE (0.59) MAPTBCHESMN1; SMN2KDM4ELMNA
SCHEMBL10826146 0.76 SLC2A1 (0.54) SLC2A1POLBMAPTTHRBBCHE
SCHEMBL9826518 0.76 CYP19A1 (0.57) POLBMAPTTHRBSMN1; SMN2KDM4E
SCHEMBL10410635 0.75 FFAR4 (0.43) SLC2A1MAPTSMN1; SMN2MTNR1AMTNR1B
SCHEMBL6812942 0.75 FOLH1 (0.45) SLC2A1POLBMAPTSMN1; SMN2MTNR1A
SCHEMBL10410172 0.75 BRD4 (0.43) SLC2A1MTNR1AMTNR1BFFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0221346-B1 (N-SUBSTITUTED-2-HYDROXY) BENZAMIDES AND N-SUBSTITUTED-2-HYDROXY-ALPHA-OXO-BENZENEACETAMIDES AND PHARMACEUTICAL COMPOSITIONS THEREOF HAVING ACTIVITY AS MODULATORS OF THE ARACHIDONIC ACID CASCADE WARNER-LAMBERT COMPANY (US) 1991-01-30 EP disclosed
US-4939133-A N-substituted-2-hydroxy-α-oxo-benzeneacetamides and pharmaceutical compositions having activity as modulators of the arachidonic acid cascade WARNER-LAMBERT COMPANY (US) 1990-07-03 US disclosed
EP-0221346-A1 (N-substituted-2-hydroxy) benzamides and N-substituted-2-hydroxy-alpha-oxo-benzeneacetamides and pharmaceutical compositions thereof having activity as modulators of the arachidonic acid cascade WARNER-LAMBERT COMPANY (US) 1987-05-13 EP disclosed