SCHEMBL9828064

SCHEMBL9828064

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
C5AR1 P21730 4/20 0.51
KMT2A Q03164 3/20 0.50
BCHE P06276 2/20 0.50
MEN1 O00255 2/20 0.50
ABCB1 P08183 1/20 0.50
ABCG2 Q9UNQ0 1/20 0.50
POLB P06746 1/20 0.50
MAPT P10636 1/20 0.50
THRB P10828 1/20 0.50
KDM4E B2RXH2 3/20 0.49
MTNR1A P48039 2/20 0.49
MTNR1B P49286 2/20 0.49
LMNA P02545 2/20 0.49
HTT P42858 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
ALDH1A1 P00352 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49

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
SCHEMBL28907176 0.86 C5AR1 (0.61) SLC2A1C5AR1KMT2AMEN1POLB
SCHEMBL9826953 0.82 SLC2A1 (0.54) SLC2A1C5AR1KMT2ABCHEMEN1
Hydrochloric Acid SCHEMBL11290284 0.81 SLC2A1 (0.59) SLC2A1KMT2ABCHEMEN1POLB
SCHEMBL9826817 0.80 MAOB (0.58) SLC2A1KMT2AMEN1ABCB1ABCG2
SCHEMBL28852579 0.80 KDM4E (0.55) SLC2A1KMT2AMEN1POLBMAPT
SCHEMBL6979978 0.77 FFAR4 (0.54) C5AR1KMT2AMEN1MAPTHTT
SCHEMBL360371 0.76 CYP4F2 (0.63) SLC2A1KMT2ABCHEMEN1POLB
SCHEMBL7802750 0.76 SLC2A1 (0.54) SLC2A1KMT2ABCHEMEN1KDM4E
SCHEMBL7338652 0.76 SLC2A1 (0.54) SLC2A1KMT2AMEN1KDM4EMTNR1A
SCHEMBL3272392 0.76 SLC2A1 (0.54) SLC2A1KMT2AMEN1KDM4EMTNR1A

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