SCHEMBL5320644

SCHEMBL5320644

COc1cc(C(=O)CC(=O)c2ccc(O)cc2O)cc(OC)c1OC

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.54
KMT2A Q03164 6/20 0.54
ALDH1A1 P00352 4/20 0.54
NPC1 O15118 4/20 0.54
RAB9A P51151 3/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
MAPT P10636 2/20 0.54
TTR P02766 1/20 0.54
GAA P10253 1/20 0.54
KDM4E B2RXH2 2/20 0.52
IDO1 P14902 1/20 0.52
TDO2 P48775 1/20 0.52
HPGD P15428 2/20 0.50
HSP90AB1 P08238 1/20 0.50
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA7 P43166 1/20 0.50
PDK2 Q15119 1/20 0.50
PDK4 Q16654 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
SCHEMBL5346443 0.86 MEN1 (0.73) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL9530950 0.84 KMT2A (0.75) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL5342594 0.83 NPC1 (0.64) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL5710003 0.82 TUBB4A (0.59) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL30375359 0.82 TUBB4A (0.59) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL7046987 0.82 ALDH1A1 (0.72) MEN1KMT2AALDH1A1SMN1; SMN2MAPT
SCHEMBL7549549 0.78 HSP90AB1 (0.70) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL7468407 0.78 KMT2A (0.59) MEN1KMT2AALDH1A1NPC1SMN1; SMN2
SCHEMBL9343430 0.77 MEN1 (0.67) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL1259813 0.77 NPC1 (0.65) MEN1KMT2AALDH1A1NPC1RAB9A

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-1807408-B1 OXY SUBSTITUTED FLAVONES AS ANTIHYPERGLYCEMIC AND ANTIDYSLIPIDEMIC AGENTS COUNCIL SCIENT IND RES (IN) 2016-06-08 EP disclosed
EP-1807408-A1 OXY SUBSTITUTED FLAVONES AS ANTIHYPERGLYCEMIC AND ANTIDYSLIPIDEMIC AGENTS Council of Scientific and Industrial Research (IN) 2007-07-18 EP disclosed
WO-2006040621-A1 OXY SUBSTITUTED FLAVONES AS ANTIHYPERGLYCEMIC AND ANTIDYSLIPIDEMIC AGENTS COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2006-04-20 WO disclosed