SCHEMBL325665

SCHEMBL325665

CCC(O)(CC)OC(O)(CC)CC

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.37
TDP1 Q9NUW8 2/20 0.37
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL10345344 0.81 ALDH1A1 (0.30) TSHRTDP1ALDH1A1
SCHEMBL10902320 0.78
SCHEMBL11203236 0.74 MAPT (0.33)
SCHEMBL6403891 0.74 HMGCR (0.46) TSHRTDP1ALDH1A1
SCHEMBL2916123 0.74
SCHEMBL8971155 0.72
SCHEMBL170479 0.69 TSHR (0.32) TSHRTDP1ALDH1A1
SCHEMBL11661453 0.67 FDPS (0.36) TSHRALDH1A1
SCHEMBL11322321 0.67
Amylene Hydrate SCHEMBL9619268 0.67

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 198 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3923908-A1 NOVEL COMPOSITION Reckitt Benckiser Health Limited (GB) 2021-12-22 EP claimed
CN-113557009-A Novel compositions 雷克特本克斯尔健康有限公司 2021-10-26 CN claimed
WO-2020165578-A1 NOVEL COMPOSITION Reckitt Benckiser Health Limited (GB) 2020-08-20 WO claimed
US-10363316-B2 Pharmaceutical formulation comprising NSAID and cyclodextrin RECKITT BENCKISER HEALTHCARE (UK) LIMITED (GB) 2019-07-30 US claimed
CN-103260617-B Comprise the pharmaceutical preparation of NSAID and cyclodextrin 雷克特本克斯尔医疗保健国际有限公司 2016-08-24 CN claimed
EP-2651409-B1 NOVEL PHARMACEUTICAL FORMULATION COMPRISING NSAID AND CYCLODEXTRIN RECKITT BENCKISER HEALTHCARE INT LTD (GB) 2016-08-10 EP claimed
US-20160008478-A1 Pharmaceutical Formulation Comprising NSAID And Cyclodextrin RECKITT BENCKISER HEALTHCARE INTERNATIONAL LIMITED (GB) 2016-01-14 US claimed
US-9138482-B2 Pharmaceutical formulation comprising NSAID and cyclodextrin RECKITT BENCKISER HEALTHCARE INTERNATIONAL LIMITED (GB) 2015-09-22 US claimed
US-20140296342-A1 Pharmaceutical Formulation Comprising NSAID And Cyclodextrin RECKITT BENCKISER HEALTHCARE INTERNATIONAL LIMITED (GB) 2014-10-02 US claimed
CN-103260617-A Novel pharmaceutical formulation comprising NSAID and cyclodextrin RECKITT BENCKISER HEALTHCARE INT LTD 2013-08-21 CN claimed
US-20240165073-A1 ISOFLAVONOID COMPOSITIONS AND METHODS FOR THE TREATMENT OF CANCER Aardvark Therapeutics, Inc. 2024-05-23 US disclosed
US-20230372287-A1 ISOFLAVONOID COMPOUNDS AND METHODS FOR THE TREATMENT OF CANCER Aardvark Therapeutics, Inc. 2023-11-23 US disclosed
WO-2023161452-A1 SOLID AND ORAL ETOPOSIDE TONIRIBATE COMPOSITIONS CELLACT PHARMA GMBH (DE) 2023-08-31 WO disclosed
EP-4233837-A1 SOLID AND ORAL ETOPOSIDE TONIRIBATE COMPOSITIONS CellAct Pharma GmbH (DE) 2023-08-30 EP disclosed
US-11723893-B2 Isoflavonoid compositions and methods for the treatment of cancer MEI PHARMA, INC. (US) 2023-08-15 US disclosed
WO-2000001734-A1 LINEAR CYCLODEXTRIN COPOLYMERS CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2000-01-13 WO disclosed
EP-0579435-B1 Cyclodextrin complexation CYCLOPS H F (IS) 1999-03-17 EP disclosed
US-5472954-A Combining cyclodextrin with polymer before adding active material CYCLOPS H.F. (IS) 1995-12-05 US disclosed
US-5324718-A Complexing with natural and synthetic polymers; high speed drug release CYCLOPS H.F. (IS) 1994-06-28 US disclosed
EP-0579435-A1 Cyclodextrin complexation CYCLOPS h.f. (IS) 1994-01-19 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 (3 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-11723893-B2 Isoflavonoid compositions and methods for the treatment of cancer BAX, CASP3, SI TSHR 4857/4885TDP1 4478/4885ALDH1A1 3916/4885
US-20240165073-A1 ISOFLAVONOID COMPOSITIONS AND METHODS FOR THE TREATMENT OF CANCER BAX, CASP3, SI TSHR 4857/4885TDP1 4478/4885ALDH1A1 3916/4885
US-20230372287-A1 ISOFLAVONOID COMPOUNDS AND METHODS FOR THE TREATMENT OF CANCER BAX, CASP3, API5 TSHR 4715/4885TDP1 4483/4885ALDH1A1 2318/4885

“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.