SCHEMBL6903921

SCHEMBL6903921

C[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)[C@H]1OC(Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@@H](O)[C@@H]1O

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 1/20 0.70
RPS6KA3 P51812 4/20 0.69
P4HB P07237 7/20 0.65
AKR1B1 P15121 3/20 0.65
CA12 O43570 2/20 0.65
CA2 P00918 2/20 0.65
CA4 P22748 2/20 0.65
CA7 P43166 2/20 0.65
ACHE P22303 1/20 0.65
CYP3A4 P08684 3/20 0.61
XDH P47989 3/20 0.60
L3MBTL1 Q9Y468 3/20 0.60
SLCO2B1 O94956 2/20 0.60
MAOA P21397 2/20 0.60
EPHX2 P34913 2/20 0.60
PIM2 Q9P1W9 2/20 0.60
KDM4E B2RXH2 1/20 0.60
ALDH1A1 P00352 1/20 0.60
POLB P06746 1/20 0.60
GAA P10253 1/20 0.60

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
SCHEMBL8374228 0.93 KDM4E (0.71) P4HBAKR1B1CA12CA2CA4
SCHEMBL925803 0.93 KDM4E (0.71) P4HBAKR1B1CA12CA2CA4
SCHEMBL31720459 0.88 P4HB (0.69) RPS6KA3P4HBAKR1B1CA12CA2
SCHEMBL6905094 0.88 MEN1 (0.66) NQO2RPS6KA3P4HBAKR1B1CA12
SCHEMBL10379812 0.86 MAOA (0.53) NQO2RPS6KA3P4HBAKR1B1CA12
SCHEMBL2510457 0.86 NQO2 (0.72) NQO2RPS6KA3P4HBAKR1B1CA12
Afzelin SCHEMBL15918354 0.82 NQO2 (1.00) NQO2RPS6KA3P4HBAKR1B1CA12
Afzelin SCHEMBL1689477 0.82 NQO2 (1.00) NQO2RPS6KA3P4HBAKR1B1CA12
Afzelin SCHEMBL14690855 0.82 NQO2 (1.00) NQO2RPS6KA3P4HBAKR1B1CA12
Kaempferol-3-O-Rhamnoside SCHEMBL15917403 0.82 NQO2 (1.00) NQO2RPS6KA3P4HBAKR1B1CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105749258-A Sugar-reducing composition containing glipizide and preparation method thereof 卢连伟 2016-07-13 CN disclosed
CN-105709228-A Medicine composition used for treating myocardial ischemia and preparation method thereof 张长青 2016-06-29 CN disclosed
US-6814985-B1 USEFUL IN THE TREATMENT OR PROPHYLAXIS OF TYPE I HYPERSENSITIVITY REACTIONS SUCH AS BUT NOT LIMITED TO IGE-BASED RESPIRATORY DISORDERS G & W Aust Pty. Ltd. (AU) 2004-11-09 US disclosed
WO-2002094303-A1 POMEGRANATE PRODUCTS USEFUL IN IMPROVING HEALTH AND METHODS OF USE THEREOF RIMONEST LTD. (IL) 2002-11-28 WO disclosed
EP-1210094-A4 HERBAL COMPOSITIONS AND USES FOR THE TREATMENT OF ALLERGIC REACTIONS HU GUORANG (AU) 2002-10-16 EP disclosed
EP-1210094-A1 HERBAL COMPOSITIONS AND USES FOR THE TREATMENT OF ALLERGIC REACTIONS Hu, Guorang (AU) 2002-06-05 EP disclosed
US-20020012710-A1 Pomegranate products useful in improving health and methods of use thereof RIMONEST LTD. 2002-01-31 US disclosed
WO-2000059520-A1 HERBAL COMPOSITIONS AND USES FOR THE TREATMENT OF ALLERGIC REACTIONS HU GUORANG (AU) 2000-10-12 WO disclosed
EP-0524744-B1 Base board for printed circuit board MITSUBISHI GAS CHEMICAL CO (JP) 1995-06-21 EP disclosed
US-5266385-A For inspection of printed circuit patterns MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1993-11-30 US disclosed
EP-0524744-A1 Base board for printed circuit board MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1993-01-27 EP disclosed
EP-0237066-B1 FLAVONE GLYCOSIDE, A PROCESS FOR ITS PREPARATION AND PHARMACEUTICAL COMPOSITION CONTAINING IT DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1991-06-26 EP disclosed
WO-1990006104-A1 USE OF KAEMPFEROL AND CERTAIN DERIVATIVES THEREOF FOR THE PREPARATION OF A COSMETIC OR PHARMACEUTICAL COMPOSITION LVMH RECHERCHE (FR) 1990-06-14 WO disclosed
US-4753929-A Flavone glycoside DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1988-06-28 US disclosed
EP-0237066-A2 Flavone glycoside, a process for its preparation and pharmaceutical composition containing it DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1987-09-16 EP disclosed