SCHEMBL29453024

SCHEMBL29453024

O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12

nearest known ligand 0.87

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P4HB P07237 4/20 0.87
▸ AKR1B1 P15121 4/20 0.87
▸ CA12 O43570 2/20 0.87
▸ CA2 P00918 2/20 0.87
▸ CA4 P22748 2/20 0.87
▸ CA7 P43166 2/20 0.87
▸ ACHE P22303 1/20 0.87
▸ KDM4E B2RXH2 4/20 0.76
▸ GAA P10253 4/20 0.76
▸ POLB P06746 3/20 0.76
▸ APEX1 P27695 1/20 0.76
▸ RECQL P46063 1/20 0.76
▸ EPHX2 P34913 5/20 0.75
▸ SMN1; SMN2 Q16637 3/20 0.75
▸ MAPT P10636 2/20 0.75
▸ SLCO2B1 O94956 2/20 0.75
▸ LMNA P02545 2/20 0.75
▸ ADRA2C P18825 1/20 0.75
▸ NOX4 Q9NPH5 1/20 0.75
▸ KDM1A O60341 1/20 0.75

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
SCHEMBL30217565 1.00 P4HB (0.87) P4HBAKR1B1CA12CA2CA4
SCHEMBL27193647 1.00 P4HB (0.87) P4HBAKR1B1CA12CA2CA4
SCHEMBL9993788 1.00 P4HB (0.87) P4HBAKR1B1CA12CA2CA4
SCHEMBL4391457 1.00 P4HB (0.87) P4HBAKR1B1CA12CA2CA4
SCHEMBL31173775 1.00 P4HB (0.87) P4HBAKR1B1CA12CA2CA4
SCHEMBL30456667 0.95 P4HB (0.79) P4HBAKR1B1CA12CA2CA4
SCHEMBL9993267 0.95 P4HB (0.79) P4HBAKR1B1CA12CA2CA4
SCHEMBL30217549 0.95 P4HB (0.79) P4HBAKR1B1CA12CA2CA4
SCHEMBL30637576 0.95 P4HB (0.79) P4HBAKR1B1CA12CA2CA4
SCHEMBL31720497 0.95 P4HB (0.79) P4HBAKR1B1CA12CA2CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119055666-A Application of active compound derived from epimedium total flavone in inhibiting androgen receptor 山西医科大学 2024-12-03 — — CN claimed
US-20250339399-A1 SUPRAMOLECULAR SELF-ASSEMBLY SYSTEM BEIJING CREATRON INSTITUTE OF PHARMACEUTICAL RES CO LTD (CN) 2025-11-06 — — US disclosed
CN-114031656-B Medicine for treating urinary system lithiasis related diseases and preparation method thereof 张弘 2025-05-27 — — CN disclosed
CN-119818577-A Traditional Chinese medicine composition with vaginal tightening effect and preparation method and application thereof 广东格美健康科技有限公司 2025-04-15 — — CN disclosed
CN-119055666-A Application of active compound derived from epimedium total flavone in inhibiting androgen receptor 山西医科大学 2024-12-03 — — CN disclosed
CN-119055666-A Application of active compound derived from epimedium total flavone in inhibiting androgen receptor 山西医科大学 2024-12-03 — — CN disclosed
CN-117582464-A Extraction method and application of active ingredients for treating cerebral infarction in Va drug Nie Liang administration 云南省中医医院(云南中医药大学第一附属医院) 2024-02-23 — — CN disclosed
CN-115212252-A Application of Va drug Nierone in preparation of drugs for treating cerebral infarction 云南省中医医院(云南中医药大学第一附属医院) 2022-10-21 — — CN disclosed
WO-2022151978-A1 DRUG FOR TREATING UROLITHIASIS-RELATED DISEASE, AND PREPARATION METHOD THEREFOR 张弘 2022-07-21 — — WO disclosed
CN-114031656-A Medicine for treating urinary calculus related diseases and preparation method thereof 张弘 2022-02-11 — — 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-20250339399-A1 SUPRAMOLECULAR SELF-ASSEMBLY SYSTEM S100A8, TP53, AQP1 P4HB 1151/4885AKR1B1 2311/4885CA12 50/4885

“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.

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