SCHEMBL15467475

SCHEMBL15467475

COC1=C(O)CC(C=CC(=O)c2ccc(O)cc2O)C=C1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.47
KMT2A Q03164 7/20 0.47
CYP3A4 P08684 6/20 0.47
MAPT P10636 5/20 0.47
MAPK1 P28482 5/20 0.47
ABCG2 Q9UNQ0 4/20 0.47
HPGD P15428 4/20 0.47
ALOX15 P16050 4/20 0.47
TP53 P04637 3/20 0.47
ALDH1A1 P00352 3/20 0.47
LMNA P02545 3/20 0.47
HSD17B10 Q99714 3/20 0.47
TDP1 Q9NUW8 4/20 0.46
NFKB1 P19838 4/20 0.46
NFKB2 Q00653 3/20 0.46
RELA Q04206 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
NR1H4 Q96RI1 2/20 0.46
ALOX12 P18054 1/20 0.46
CTSL P07711 1/20 0.43

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
SCHEMBL31527884 0.92 MEN1 (0.48) MEN1KMT2AMAPTMAPK1HPGD
SCHEMBL27183383 0.92 MEN1 (0.48) MEN1KMT2AMAPTMAPK1HPGD
SCHEMBL31527864 0.86 MAOB (0.45) MEN1KMT2ACYP3A4MAPTMAPK1
SCHEMBL27182973 0.86 MAOB (0.45) MEN1KMT2ACYP3A4MAPTMAPK1
SCHEMBL2022872 0.84 CYP3A4 (0.47) MEN1KMT2ACYP3A4MAPTMAPK1
SCHEMBL2023335 0.84 MEN1 (0.47) MEN1KMT2ACYP3A4MAPTMAPK1
SCHEMBL31527893 0.81 CA12 (0.40) MEN1KMT2AMAPTMAPK1HPGD
SCHEMBL27183279 0.81 CA12 (0.40) MEN1KMT2AMAPTMAPK1HPGD
SCHEMBL31527674 0.79 AR (0.40) MEN1KMT2AMAPTMAPK1HPGD
SCHEMBL27182885 0.79 AR (0.40) MEN1KMT2AMAPTMAPK1HPGD

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
US-9359622-B2 Method for biotechnological production of dihydrochalcones SYMRISE AG (DE) 2016-06-07 US disclosed
US-20140045233-A1 Method for Biotechnological Production of Dihydrochalcones SYMRISE AG (DE) 2014-02-13 US disclosed