SCHEMBL14967232

SCHEMBL14967232

COC(=O)c1ccc(CCOc2ccccc2O)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.53
TDP1 Q9NUW8 1/20 0.53
CYP4A11 Q02928 2/20 0.51
MAPT P10636 4/20 0.50
RAB9A P51151 2/20 0.50
HPGD P15428 2/20 0.50
ALDH1A1 P00352 1/20 0.50
TP53 P04637 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C9 P11712 1/20 0.50
ALOX15 P16050 1/20 0.50
ALOX12 P18054 1/20 0.50
CYP2C19 P33261 1/20 0.50
CKS1B P61024 1/20 0.50
SKP2 Q13309 1/20 0.50
HIF1A Q16665 1/20 0.50
HSD17B10 Q99714 1/20 0.50
CYP4F2 P78329 1/20 0.50
LMNA P02545 4/20 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
SCHEMBL14967138 0.86 L3MBTL1 (0.72) L3MBTL1TDP1CYP4A11MAPTRAB9A
SCHEMBL14966824 0.84 L3MBTL1 (0.52) L3MBTL1TDP1CYP4A11MAPTRAB9A
SCHEMBL14967118 0.84 JAK2 (0.53) MAPTHPGDLMNAJAK2GAA
SCHEMBL17844325 0.83 HPGD (0.57) L3MBTL1CYP4A11MAPTRAB9AHPGD
SCHEMBL8409671 0.82 ABCB1 (0.51) L3MBTL1TDP1MAPTRAB9AHPGD
SCHEMBL5392156 0.81 MAPT (0.77) L3MBTL1TDP1CYP4A11MAPTRAB9A
SCHEMBL8409674 0.80 L3MBTL1 (0.48) L3MBTL1TDP1CYP4A11MAPTRAB9A
SCHEMBL14967229 0.79 L3MBTL1 (0.71) L3MBTL1TDP1CYP4A11MAPTRAB9A
SCHEMBL15079848 0.78 GAA (0.62) MAPTRAB9ALMNAJAK2GAA
SCHEMBL1833210 0.78 GAA (0.67) MAPTRAB9ALMNAJAK2GAA

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-2780014-A1 MODULATORS OF METHYL MODIFYING ENZYMES, COMPOSITIONS AND USES THEREOF Constellation Pharmaceuticals, Inc. (US) 2014-09-24 EP disclosed
WO-2013075083-A1 MODULATORS OF METHYL MODIFYING ENZYMES, COMPOSITIONS AND USES THEREOF CONSTELLATION PHARMACEUTICALS (US) 2013-05-23 WO disclosed