SCHEMBL30185877

SCHEMBL30185877

OC[C@H]1O[C@@H](Oc2cc3c(O)cc(O)cc3[o+]c2-c2cc(O)c(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CD38 P28907 4/20 0.81
DPP4 P27487 1/20 0.81
F2 P00734 1/20 0.72
EPHX2 P34913 1/20 0.50
SLC28A3 Q9HAS3 3/20 0.49
EGFR P00533 2/20 0.49
KDR P35968 2/20 0.49
SNCA P37840 2/20 0.49
GLO1 Q04760 2/20 0.49
EP300 Q09472 2/20 0.49
CREBBP Q92793 2/20 0.49
MEN1 O00255 1/20 0.46
GAA P10253 1/20 0.46
AKR1B1 P15121 1/20 0.46
KMT2A Q03164 1/20 0.46
POLB P06746 1/20 0.46
TYR P14679 2/20 0.44
HSD17B10 Q99714 2/20 0.43
KDM4E B2RXH2 1/20 0.43
CYP3A4 P08684 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
SCHEMBL675416 1.00 CD38 (0.81) CD38DPP4F2EPHX2SLC28A3
Hydrochloric Acid SCHEMBL675415 0.99 CD38 (0.80) CD38DPP4F2EPHX2SLC28A3
Hydrochloric Acid SCHEMBL29374214 0.99 CD38 (0.80) CD38DPP4F2EPHX2SLC28A3
Hydrochloric Acid SCHEMBL31213251 0.99 CD38 (0.80) CD38DPP4F2EPHX2SLC28A3
Hydrochloric Acid SCHEMBL29894453 0.99 CD38 (0.80) CD38DPP4F2EPHX2SLC28A3
SCHEMBL318115 0.94 F2 (0.81) CD38DPP4F2EPHX2SLC28A3
SCHEMBL30901362 0.93 CD38 (0.75) CD38DPP4F2EPHX2SLC28A3
SCHEMBL30438607 0.93 CD38 (0.75) CD38DPP4F2EPHX2SLC28A3
Hydrochloric Acid SCHEMBL318114 0.93 F2 (0.80) CD38DPP4F2EPHX2SLC28A3
Hydrochloric Acid SCHEMBL29894492 0.92 CD38 (0.73) CD38DPP4F2EPHX2SLC28A3

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-115807034-B Application of UGT84A1 gene in regulation and control of anthocyanin synthesis 中国农业科学院北京畜牧兽医研究所 2023-05-26 CN disclosed
EP-4167739-A1 ORGANIC COMPOSITION FOR BIO-STIMULATION OF A PLANT Thesis B.V. (NL) 2023-04-26 EP disclosed
CN-115807034-A Application of UGT84A1 gene in regulation and control of anthocyanin synthesis 中国农业科学院北京畜牧兽医研究所 2023-03-17 CN disclosed