SCHEMBL5796864

SCHEMBL5796864

COc1c(-c2ccc(O)cc2)oc2ccccc2c1=O

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 6/20 0.78
CYP3A4 P08684 8/20 0.68
ALDH1A1 P00352 7/20 0.68
HSD17B10 Q99714 6/20 0.68
HPGD P15428 4/20 0.68
MEN1 O00255 3/20 0.68
KMT2A Q03164 3/20 0.68
USP2 O75604 1/20 0.68
ALOX15 P16050 1/20 0.68
MAPK1 P28482 1/20 0.68
SMN1; SMN2 Q16637 1/20 0.68
FTO Q9C0B1 1/20 0.68
KDM4E B2RXH2 8/20 0.65
CYP2D6 P10635 3/20 0.65
POLB P06746 1/20 0.65
APEX1 P27695 1/20 0.65
RECQL P46063 1/20 0.65
MCL1 Q07820 1/20 0.65
POLH Q9Y253 1/20 0.65
MAPT P10636 4/20 0.62

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
SCHEMBL29993383 0.88 ABCG2 (1.00) ABCG2CYP3A4ALDH1A1HSD17B10HPGD
SCHEMBL253523 0.88 ABCG2 (1.00) ABCG2CYP3A4ALDH1A1HSD17B10HPGD
SCHEMBL4650702 0.87 ABCG2 (1.00) ABCG2CYP3A4ALDH1A1HSD17B10HPGD
SCHEMBL7162949 0.85 KDM4E (0.74) ABCG2CYP3A4ALDH1A1HSD17B10HPGD
SCHEMBL3282447 0.85 KDM4E (0.71) ABCG2CYP3A4ALDH1A1HSD17B10HPGD
SCHEMBL12313777 0.83 ALDH1A1 (0.65) ABCG2CYP3A4ALDH1A1HSD17B10HPGD
SCHEMBL311968 0.82 CYP3A4 (0.72) ABCG2CYP3A4ALDH1A1HSD17B10HPGD
SCHEMBL12266094 0.82 ALDH1A1 (0.63) ABCG2CYP3A4ALDH1A1HSD17B10HPGD
SCHEMBL311942 0.82 ALDH1A1 (0.63) ABCG2CYP3A4ALDH1A1HSD17B10HPGD
SCHEMBL345696 0.81 MEN1 (1.00) CYP3A4ALDH1A1HSD17B10HPGDMEN1

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
CN-212757256-U Be applied to drying device that buchanania chinensis draws flavonoid composition 赣南卫生健康职业学院 2021-03-23 CN disclosed
WO-2006030322-A2 USE OF FLA VONE/FLA VANONE DERIVATIVES FN THE TREATMENT OR PREVENTION OF RESPIRATORY CONDITIONS UNIVERSITY OF MANITOBA (CA) 2006-03-23 WO disclosed
EP-0233105-A1 Therapeutical compositions based on 3-alkoxyflavone derivatives and derivatives of 3-alkoxyflavones INSTITUT PASTEUR (FR) 1987-08-19 EP disclosed