SCHEMBL257604

SCHEMBL257604

Cc1ccc(Oc2cccc(Oc3cccc4ccccc34)c2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
TDP1 Q9NUW8 1/20 0.45
ALDH1A1 P00352 3/20 0.45
GAA P10253 3/20 0.45
CARM1 Q86X55 1/20 0.43
PRMT6 Q96LA8 1/20 0.43
LMNA P02545 3/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
SLC6A4 P31645 3/20 0.43
HTR2A P28223 2/20 0.43
MITF O75030 2/20 0.43
POLB P06746 1/20 0.43
SMN1; SMN2 Q16637 4/20 0.42
MAPT P10636 2/20 0.42
GFER P55789 1/20 0.42
NLRP1 Q9C000 1/20 0.42
NOD2 Q9HC29 1/20 0.42
SIRT2 Q8IXJ6 1/20 0.42

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
SCHEMBL8737442 0.92 SLC6A4 (0.49) HTTL3MBTL1ALDH1A1GAACARM1
SCHEMBL10597815 0.88 KCNA3 (0.51) HTTL3MBTL1TDP1ALDH1A1GAA
SCHEMBL7457094 0.86 KCNA3 (0.52) HTTL3MBTL1TDP1ALDH1A1GAA
SCHEMBL2354199 0.85 ALDH1A1 (0.62) HTTL3MBTL1TDP1ALDH1A1GAA
SCHEMBL2078871 0.82 L3MBTL1 (0.54) HTTL3MBTL1TDP1ALDH1A1GAA
SCHEMBL441860 0.80 KCNA3 (0.58) HTTL3MBTL1TDP1ALDH1A1GAA
SCHEMBL29860318 0.80 KCNA3 (0.58) HTTL3MBTL1TDP1ALDH1A1GAA
SCHEMBL15085780 0.80 SMN1; SMN2 (0.60) HTTL3MBTL1TDP1ALDH1A1GAA
SCHEMBL83816 0.80 TDP1 (0.61) HTTL3MBTL1TDP1ALDH1A1GAA
SCHEMBL12260794 0.80 CA1 (0.57) HTTL3MBTL1ALDH1A1GAACARM1

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-2404607-A1 Boronic acids and esters as inhibitors of fatty acid amide hydrolase Infinity Pharmaceuticals, Inc. (US) 2012-01-11 EP disclosed
EP-2399585-A1 Boronic acids and esters as inhibitors of fatty acid amide hydrolase Infinity Pharmaceuticals, Inc. (US) 2011-12-28 EP disclosed