SCHEMBL4160544

SCHEMBL4160544

CC(=O)Oc1c(-c2ccc(O)cc2)oc2cc(O)cc(O)c2c1=O

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 10/20 0.75
CYP2D6 P10635 5/20 0.75
POLH Q9Y253 4/20 0.75
KDM4E B2RXH2 3/20 0.75
POLB P06746 2/20 0.75
APEX1 P27695 2/20 0.75
RECQL P46063 2/20 0.75
MCL1 Q07820 1/20 0.75
RPS6KA3 P51812 6/20 0.64
ABCB1 P08183 2/20 0.64
MEN1 O00255 2/20 0.64
MAPT P10636 2/20 0.64
KMT2A Q03164 2/20 0.64
HSD17B10 Q99714 2/20 0.64
CA12 O43570 1/20 0.64
SLCO2B1 O94956 1/20 0.64
CCNB2 O95067 1/20 0.64
ALDH1A1 P00352 1/20 0.64
CA2 P00918 1/20 0.64
LMNA P02545 1/20 0.64

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
SCHEMBL30627917 1.00 CYP3A4 (0.75) CYP3A4CYP2D6POLHKDM4EPOLB
SCHEMBL30627918 1.00 CYP3A4 (0.75) CYP3A4CYP2D6POLHKDM4EPOLB
SCHEMBL4157325 0.91 ABCB1 (0.76) CYP3A4CYP2D6POLHKDM4EPOLB
SCHEMBL31548920 0.91 CYP3A4 (0.80) CYP3A4CYP2D6POLHKDM4EPOLB
SCHEMBL4175201 0.90 POLH (0.76) CYP3A4CYP2D6POLHKDM4EPOLB
SCHEMBL31236662 0.90 POLH (0.76) CYP3A4CYP2D6POLHKDM4EPOLB
SCHEMBL4161561 0.88 CYP3A4 (0.65) CYP3A4CYP2D6POLHKDM4EPOLB
SCHEMBL4156001 0.87 POLH (0.70) CYP3A4CYP2D6POLHKDM4EPOLB
SCHEMBL30627915 0.86 TUBB4A (0.81) CYP3A4CYP2D6POLHKDM4EPOLB
Isokaempferide SCHEMBL1628023 0.86 POLH (1.00) CYP3A4CYP2D6POLHKDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117560996-A Flavor modifying compositions containing lactase 弗门尼舍有限公司 2024-02-13 CN claimed
US-20090130051-A1 Flavonoid Compounds and Uses Thereof HOWARD FLOREY INSTITUTE OF EXPERIMENTAL PHYSIOLOGY AND MEDICINE (AU) 2009-05-21 US claimed
CN-115315195-B Hydroxy-and methoxy-substituted flavonoids and use thereof 弗门尼舍有限公司 2024-07-02 CN disclosed
CN-115315194-B Hydroxy-and methoxy-substituted flavones and use thereof 弗门尼舍有限公司 2024-06-21 CN disclosed
CN-117098460-A Sweetener composition comprising mogrosides and uses thereof 弗门尼舍公司 2023-11-21 CN disclosed
CN-116997263-A Sweetener compositions comprising siamenoside I and uses thereof 弗门尼舍公司 2023-11-03 CN disclosed
CN-116963609-A Sweetener composition comprising mogrosides and uses thereof 弗门尼舍公司 2023-10-27 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090130051-A1 Flavonoid Compounds and Uses Thereof CAT, NQO1, GPX4 CYP3A4 518/4885CYP2D6 297/4885POLH 3392/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.