SCHEMBL325667

SCHEMBL325667

CCC(O)CCOCCC(O)CC

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.36
HSD17B10 Q99714 1/20 0.35
USP2 O75604 1/20 0.32
KDM4E B2RXH2 1/20 0.32
HTT P42858 1/20 0.31

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
SCHEMBL3259045 0.89
SCHEMBL4201207 0.88 TSHR (0.50) TSHRUSP2HTT
SCHEMBL20215110 0.87 HSD17B10 (0.46) TSHRHSD17B10USP2KDM4EHTT
SCHEMBL31544297 0.87 STAT3 (0.32) TSHRHSD17B10
SCHEMBL10970630 0.86 USP2 (0.52) TSHRUSP2HTT
SCHEMBL4454453 0.84 USP2 (0.55) TSHRUSP2HTT
SCHEMBL11521327 0.83 USP2 (0.39) TSHRHSD17B10USP2HTT
SCHEMBL2457163 0.82 ALDH1A1 (0.35)
SCHEMBL15740389 0.81 TSHR (0.33) TSHR
SCHEMBL8835123 0.81 HSD17B10 (0.41) TSHRHSD17B10USP2KDM4EHTT

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 214 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
EP-0127098-B1 DERIVATIVES OF BETA-AMINO-GAMMA-TRIMETHYLAMMONIO-BUTYRATE, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1989-02-08 EP disclosed
US-4767781-A ANTIDIABETIC AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1988-08-30 US disclosed
EP-0149197-A2 Pharmaceutical compositions containing drugs which are sparingly soluble in water or instable and methods for their preparation JANSSEN PHARMACEUTICA N.V. (BE) 1985-07-24 EP disclosed
EP-0127098-A2 Derivatives of beta-amino-gamma-trimethylammonio-butyrate, their production and use Takeda Chemical Industries, Ltd. (JP) 1984-12-05 EP disclosed
US-4259333-A ANTIBIOTICS, BACTERICIDES LEO PHARMACEUTICAL PRODUCTS LTD. A/S (LOVENS KEMISKE FABRIK PRODUKTIONSAKTIESELSKAB) (DK) 1981-03-31 US 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 4857/4885HSD17B10 576/4885USP2 3163/4885
US-20240165073-A1 ISOFLAVONOID COMPOSITIONS AND METHODS FOR THE TREATMENT OF CANCER BAX, CASP3, SI TSHR 4857/4885HSD17B10 576/4885USP2 3163/4885
US-20230372287-A1 ISOFLAVONOID COMPOUNDS AND METHODS FOR THE TREATMENT OF CANCER BAX, CASP3, API5 TSHR 4715/4885HSD17B10 954/4885USP2 2315/4885

“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.