SCHEMBL4124452

SCHEMBL4124452

COc1cc2oc(-c3cccc(O)c3)c(OC)c(=O)c2c(OC)c1OC

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 4/20 0.63
ABCG2 Q9UNQ0 4/20 0.63
MEN1 O00255 2/20 0.61
KMT2A Q03164 2/20 0.61
POLB P06746 1/20 0.61
MAPT P10636 1/20 0.61
ALOX5 P09917 3/20 0.60
KDM4E B2RXH2 1/20 0.59
ALDH1A1 P00352 1/20 0.59
CYP3A4 P08684 1/20 0.59
CYP2C9 P11712 1/20 0.59
MAPK1 P28482 1/20 0.59
HSD17B10 Q99714 1/20 0.59
TUBB4A P04350 2/20 0.58
TUBB P07437 2/20 0.58
TUBA3C P0DPH7 2/20 0.58
TUBA1B P68363 2/20 0.58
TUBA4A P68366 2/20 0.58
TUBB4B P68371 2/20 0.58
TUBB3 Q13509 2/20 0.58

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
SCHEMBL2727281 0.86 ABCG2 (0.83) ABCB1ABCG2MEN1KMT2APOLB
SCHEMBL774317 0.86 ADORA3 (0.72) ABCB1ABCG2MEN1KMT2APOLB
SCHEMBL30082745 0.84 MEN1 (0.84) ABCB1ABCG2MEN1KMT2APOLB
SCHEMBL30082748 0.84 ABCG2 (0.74) ABCB1ABCG2MEN1KMT2APOLB
SCHEMBL28980660 0.83 XDH (0.74) ABCB1ABCG2MEN1KMT2APOLB
SCHEMBL16894630 0.82 TUBB4A (0.70) ABCB1ABCG2MEN1KMT2APOLB
Hexamethoxyflavone SCHEMBL987569 0.82 MEN1 (0.74) ABCB1ABCG2MEN1KMT2APOLB
Hexamethoxyflavone SCHEMBL30232628 0.82 MEN1 (0.74) ABCB1ABCG2MEN1KMT2APOLB
SCHEMBL16894654 0.82 ADORA3 (0.72) ABCB1ABCG2MEN1KMT2APOLB
SCHEMBL31287150 0.82 ADORA3 (0.72) ABCB1ABCG2MEN1KMT2APOLB

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-2010194-A2 HYDROXYLATED POLYMETHOXYFLAVONE COMPOSITIONS Rutgers, The State University of New Jersey (US) 2009-01-07 EP claimed
WO-2007109071-A2 HYDROXYLATED POLYMETHOXYFLAVONE COMPOSITIONS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2007-09-27 WO claimed