SCHEMBL10646752

SCHEMBL10646752

COc1ccc(-c2oc3ccccc3c(=O)c2C(=O)O)c(OC)c1OC

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.55
CYP3A4 P08684 3/20 0.55
HSD17B10 Q99714 3/20 0.55
TSHR P16473 2/20 0.55
CYP2C9 P11712 2/20 0.55
CYP2C19 P33261 1/20 0.55
ABCG2 Q9UNQ0 3/20 0.53
MAOA P21397 4/20 0.53
ALDH1A1 P00352 6/20 0.52
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
HPGD P15428 3/20 0.52
HTT P42858 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
ALOX15 P16050 1/20 0.50
MAPT P10636 3/20 0.48
LMNA P02545 2/20 0.48
TP53 P04637 1/20 0.48
CASP1 P29466 1/20 0.48
CASP7 P55210 1/20 0.48

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
SCHEMBL9527473 0.85 KDM4E (0.71) KDM4ECYP3A4HSD17B10TSHRCYP2C9
SCHEMBL774316 0.85 KDM4E (0.75) KDM4ECYP3A4HSD17B10TSHRCYP2C9
SCHEMBL9527742 0.82 ABCG2 (0.60) KDM4ECYP3A4HSD17B10TSHRCYP2C9
SCHEMBL11813859 0.80 KDM4E (0.49) KDM4ECYP3A4HSD17B10TSHRCYP2C9
SCHEMBL31723152 0.80 MEN1 (0.72) KDM4ECYP3A4HSD17B10TSHRABCG2
SCHEMBL28425332 0.80 MEN1 (0.72) KDM4ECYP3A4HSD17B10TSHRABCG2
SCHEMBL4287358 0.76 MAOA (0.59) KDM4ECYP3A4HSD17B10TSHRCYP2C9
SCHEMBL15864329 0.76 KDM4E (0.64) KDM4ECYP3A4HSD17B10TSHRCYP2C9
SCHEMBL4649956 0.75 KDM4E (0.80) KDM4ECYP3A4HSD17B10TSHRCYP2C9
SCHEMBL28824886 0.75 ALDH1A1 (0.70) KDM4ECYP3A4HSD17B10TSHRCYP2C9

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0290915-A2 Flavone-3-carboxylic-acid compounds, and process, intermediates for their preparation and medicines containing these compounds Kali-Chemie Pharma GmbH (DE) 1988-11-17 EP disclosed