SCHEMBL16694586

SCHEMBL16694586

COc1cc(OC)c(OC)cc1/C=C/C(=O)c1ccc2c(c1O)C=CC(C)(C)O2

nearest known ligand 0.76

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ HIF1AN Q9NWT6 13/20 0.72
▸ ODC1 P11926 2/20 0.72
▸ ACHE P22303 2/20 0.68
▸ BCHE P06276 1/20 0.64
▸ PTPN1 P18031 1/20 0.64
▸ BACE1 P56817 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
SCHEMBL16694587 1.00 HIF1AN (0.72) HIF1ANODC1ACHEBCHEPTPN1
SCHEMBL16865504 0.93 HIF1AN (0.68) HIF1ANODC1ACHEBCHEPTPN1
SCHEMBL16694436 0.91 HSP90AA1 (0.61) HIF1ANODC1ACHE
SCHEMBL16694437 0.91 HSP90AA1 (0.61) HIF1ANODC1ACHE
SCHEMBL31376273 0.89 ACHE (0.73) HIF1ANODC1ACHEBCHEPTPN1
SCHEMBL31376223 0.88 HIF1AN (0.69) HIF1ANODC1ACHEBCHEPTPN1
SCHEMBL31376176 0.87 HIF1AN (0.87) HIF1ANODC1ACHEBCHEPTPN1
SCHEMBL16694388 0.87 HIF1AN (0.87) HIF1ANODC1ACHEBCHEPTPN1
SCHEMBL16694389 0.87 HIF1AN (0.87) HIF1ANODC1ACHEBCHEPTPN1
SCHEMBL31376228 0.86 HIF1AN (0.69) HIF1ANODC1ACHEBCHEPTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118311178-A Method for simultaneously measuring 22 chemical components in nose-sensitive capsule by using UPLC-MS/MS 山东省中医药研究院 2024-07-09 — — CN claimed
CN-115128186-A Fingerprint spectrum construction method, component basic identification construction method and detection method of magnolia flower rhinitis preparation 广州白云山中一药业有限公司 2022-09-30 — — CN claimed
EP-2871187-B1 NOVEL COMPOUND OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT SNU R&DB FOUNDATION (KR) 2017-09-20 — — EP claimed
US-20150183797-A1 NOVEL COMPOUND OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT SNU R&DB FOUNDATION (KR) 2015-07-02 — — US claimed
EP-2871187-A1 NOVEL COMPOUND OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT SNU R&DB Foundation (KR) 2015-05-13 — — EP claimed
CN-118903074-A Application of licarpa root chalcone in preparation of anti-liver cancer drugs and anti-liver cancer drugs 重庆医科大学国际体外诊断研究院 2024-11-08 — — CN disclosed
CN-114246847-B Application of chalcone compounds in treatment of coronavirus infection 北京化工大学 2024-01-16 — — CN disclosed
CN-111443154-B Research method of medicinal genetic relationship of glycyrrhiza 贵州中医药大学 2023-03-07 — — CN disclosed
CN-115128186-A Fingerprint spectrum construction method, component basic identification construction method and detection method of magnolia flower rhinitis preparation 广州白云山中一药业有限公司 2022-09-30 — — CN disclosed
CN-115128186-A Fingerprint spectrum construction method, component basic identification construction method and detection method of magnolia flower rhinitis preparation 广州白云山中一药业有限公司 2022-09-30 — — CN disclosed
EP-2871187-B1 NOVEL COMPOUND OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT SNU R&DB FOUNDATION (KR) 2017-09-20 — — EP disclosed
EP-2871187-B1 NOVEL COMPOUND OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT SNU R&DB FOUNDATION (KR) 2017-09-20 — — EP disclosed
US-9745280-B2 Compound or pharmaceutically acceptable salt thereof, and pharmaceutical composition containing same as active ingredient SNU R&DB FOUNDATION (KR) 2017-08-29 — — US disclosed
US-9745280-B2 Compound or pharmaceutically acceptable salt thereof, and pharmaceutical composition containing same as active ingredient SNU R&DB FOUNDATION (KR) 2017-08-29 — — US disclosed
US-20160340331-A1 NOVEL COMPOUND OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT SNU R&DB FOUNDATION (KR) 2016-11-24 — — US disclosed
US-20160340331-A1 NOVEL COMPOUND OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT SNU R&DB FOUNDATION (KR) 2016-11-24 — — US disclosed
US-20150183797-A1 NOVEL COMPOUND OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT SNU R&DB FOUNDATION (KR) 2015-07-02 — — US disclosed
US-20150183797-A1 NOVEL COMPOUND OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT SNU R&DB FOUNDATION (KR) 2015-07-02 — — US disclosed
EP-2871187-A1 NOVEL COMPOUND OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT SNU R&DB Foundation (KR) 2015-05-13 — — EP 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 (2 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-20150183797-A1 NOVEL COMPOUND OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT HSP90AB1, HSP90AA1, HIF1AN HIF1AN 3/4885ODC1 3423/4885ACHE 4868/4885
US-20160340331-A1 NOVEL COMPOUND OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT HSP90AB1, HSP90AA1, HSP90AB2P HIF1AN 4/4885ODC1 3782/4885ACHE 4870/4885

“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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