SCHEMBL5482220

SCHEMBL5482220

CC(C)OC(=O)C(O)C(O)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.50
TP53 P04637 1/20 0.41
HCAR2 Q8TDS4 1/20 0.38
NFKB1 P19838 1/20 0.33
CYP2C19 P33261 1/20 0.33
PDCD1 Q15116 1/20 0.31
CD274 Q9NZQ7 1/20 0.31
CA12 O43570 3/20 0.30
CA1 P00915 3/20 0.30
CA2 P00918 3/20 0.30
CA7 P43166 3/20 0.30
CA9 Q16790 3/20 0.30
CA14 Q9ULX7 3/20 0.30
LMNA P02545 1/20 0.30
PGD P52209 1/20 0.30

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
Cadaverine Tartrate SCHEMBL27575429 1.00 TSHR (0.50) TSHRTP53HCAR2NFKB1CYP2C19
SCHEMBL1336756 0.89 TSHR (0.50) TSHRTP53HCAR2CA12CA1
SCHEMBL1338978 0.89 TSHR (0.50) TSHRTP53HCAR2CA12CA1
SCHEMBL571478 0.89 TSHR (0.50) TSHRTP53HCAR2CA12CA1
SCHEMBL8636434 0.89 TSHR (0.50) TSHRTP53HCAR2CA12CA1
SCHEMBL10634108 0.86 PDE4A (0.41) TSHRTP53HCAR2
SCHEMBL31649104 0.86 PDE4A (0.41) TSHRTP53HCAR2
SCHEMBL981017 0.83 TSHR (0.48) TSHRTP53NFKB1CYP2C19
Ethylene Glycol SCHEMBL28051222 0.80 TSHR (0.42) TSHRHCAR2CA12CA1CA2
SCHEMBL7438737 0.80 TSHR (0.42) TSHRHCAR2CA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119104658-A Method for detecting valicarb-isopropyl tartrate genotoxic impurity D 山东百诺医药股份有限公司 2024-12-10 CN claimed
CN-117838769-A Combined suppository of valicarb-isopropyl tartrate and houttuynia cordata and preparation method thereof 湖北广济医药科技有限公司 2024-04-09 CN claimed
CN-117715910-A Nitrosamine impurity, valicarb pharmaceutical composition capable of reducing nitrosamine impurity generation, and preparation and application thereof 威智医药股份有限公司 2024-03-15 CN claimed
CN-117442575-A Vanilla pharmaceutical composition and preparation and application thereof 山东威智中科药业有限公司 2024-01-26 CN claimed
CN-117026673-A Irradiation crosslinked degradable coated paper and preparation method thereof 中广核俊尔(上海)新材料有限公司 2023-11-10 CN claimed
CN-116338025-A Method for measuring N-nitrosovalinamide by liquid chromatography-mass spectrometer 江苏嘉逸医药有限公司 2023-06-27 CN claimed
CN-113980020-B Preparation method of valicarb tartrate crystal form 浙江车头制药股份有限公司 2023-05-09 CN claimed
EP-2738164-A1 Synthesis of an intermediate of an antiviral compound Dipharma Francis S.r.l. (IT) 2014-06-04 EP claimed
US-20140148574-A1 SYNTHESIS OF AN INTERMEDIATE OF AN ANTIVIRAL COMPOUND DIPHARMA FRANCIS S.R.L. (IT) 2014-05-29 US claimed
CN-121476463-A Method for detecting sample by adopting solid phase extraction to treat related substances of valicarb-isopropyl tartrate preparation 江苏嘉逸医药有限公司 2026-02-06 CN disclosed
CN-121476463-A Method for detecting sample by adopting solid phase extraction to treat related substances of valicarb-isopropyl tartrate preparation 江苏嘉逸医药有限公司 2026-02-06 CN disclosed
CN-115707687-B Related impurity compound of valicarb-isopropyl tartrate, and preparation, application and detection methods thereof 威智医药股份有限公司 2025-07-11 CN disclosed
CN-115707687-B Related impurity compound of valicarb-isopropyl tartrate, and preparation, application and detection methods thereof 威智医药股份有限公司 2025-07-11 CN disclosed
CN-115707688-B Impurity compound in raw material for preparing valicarb-isopropyl tartrate, and preparation, application and detection methods thereof 威智医药股份有限公司 2025-05-16 CN disclosed
US-20070275022-A1 Cosmetic Hair Preparation LION CORPORATION (JP) 2007-11-29 US disclosed
CN-1222906-A Urea/ureido functional polymerizable monomers CYTEC TECH CORP (US) 1999-07-14 CN disclosed
EP-0298756-B1 Optically active allyl alcohol and process for producing leucotriene B4 using thereof NISSAN CHEMICAL IND LTD (JP) 1997-11-26 EP disclosed
US-5073646-A Chemical intermediates, microbiocides LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 1991-12-17 US disclosed
EP-0298756-A2 Optically active allyl alcohol and process for producing leucotriene B4 using thereof NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1989-01-11 EP disclosed
US-4005189-A Process of suppressing odors employing deodorants containing esters of aliphatic hydroxycarboxylic acids HENKEL & CIE G.M.B.H. (DT) 1977-01-25 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 (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-20070275022-A1 Cosmetic Hair Preparation CUTA, H1-10, PUF60 TSHR 3396/4885TP53 1184/4885HCAR2 21/4885
US-20140148574-A1 SYNTHESIS OF AN INTERMEDIATE OF AN ANTIVIRAL COMPOUND ZC3HAV1, PREP, EIF2AK2 TSHR 4732/4885TP53 1407/4885HCAR2 3629/4885

“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.