Docusate

Docusate

SCHEMBL61043

CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)[O-].[K+]

nearest known ligand 0.78

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

AGTR1DHFRGABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTNR3C2PBP2XPTGS1PTGS2VKORC1blablaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAftsImrcAmrcBmrdApbp1apbp1bpbp2apbp2bpbp3polthyA

The experimentally established mechanism targets of Docusate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.78
CYP3A4 P08684 5/20 0.56
TSHR P16473 3/20 0.56
TDP1 Q9NUW8 2/20 0.56
ATM Q13315 1/20 0.56
ALDH1A1 P00352 7/20 0.44
CA2 P00918 4/20 0.44
LMNA P02545 4/20 0.40
MAPK1 P28482 3/20 0.40
HSD17B10 Q99714 1/20 0.40
PRSS1 P07477 1/20 0.39
PRSS2 P07478 1/20 0.39
PRSS3 P35030 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MMP9 P14780 1/20 0.35
MMP8 P22894 1/20 0.35
MMP14 P50281 1/20 0.35
CA1 P00915 1/20 0.33

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
Docusate SCHEMBL7262160 0.97 RECQL (0.78) RECQLCYP3A4TSHRTDP1ATM
Docusate SCHEMBL9722552 0.97 RECQL (0.78) RECQLCYP3A4TSHRTDP1ATM
Docusate SCHEMBL29772 0.97 RECQL (0.78) RECQLCYP3A4TSHRTDP1ATM
Docusate SCHEMBL3041223 0.97 RECQL (0.78) RECQLCYP3A4TSHRTDP1ATM
Docusate SCHEMBL2310067 0.97 RECQL (0.78) RECQLCYP3A4TSHRTDP1ATM
Docusate SCHEMBL31128363 0.97 RECQL (0.78) RECQLCYP3A4TSHRTDP1ATM
Docusate SCHEMBL4113 0.97 RECQL (0.78) RECQLCYP3A4TSHRTDP1ATM
Docusate SCHEMBL13727352 0.97 RECQL (0.78) RECQLCYP3A4TSHRTDP1ATM
Docusate SCHEMBL23781730 0.96 RECQL (0.76) RECQLCYP3A4TSHRTDP1ATM
Docusate SCHEMBL22588821 0.96 RECQL (0.76) RECQLCYP3A4TSHRTDP1ATM

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 1927 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4706393-A2 STABLE HERBICIDAL COMPOSITIONS UPL Corporation Limited (MU) 2026-03-11 EP claimed
EP-3970492-B1 STABLE HERBICIDAL COMPOSITIONS UPL CORPORATION LTD (MU) 2026-01-21 EP claimed
WO-2025202951-A1 COMPOSITION OF CLOTRIMAZOLE VAGINAL FILM AND PROCESS FOR PREPARATION THEREOF HETERO HEALTHCARE LIMITED (IN) 2025-10-02 WO claimed
US-20230363386-A1 STABLE HERBICIDAL COMPOSITIONS UPL EUROPE LTD (GB) 2023-11-16 US claimed
WO-2022058748-A1 STABLE HERBICIDAL COMPOSITIONS UPL Corporation Limited (MU) 2022-03-24 WO claimed
EP-3970492-A1 STABLE HERBICIDAL COMPOSITIONS UPL Corporation Limited (MU) 2022-03-23 EP claimed
CN-114042067-A Amoxicillin sodium for injection and preparation method thereof 江西利德菲生物药业有限公司 2022-02-15 CN claimed
US-20210361663-A1 Formulations of Antiviral Compounds MERCK SHARP & DOHME CORP. (US) 2021-11-25 US claimed
CN-112089844-A Methods and compositions comprising desmopressin in combination with an M3 receptor antagonist 清远市人民医院 2020-12-18 CN claimed
US-20200114012-A1 METHOD FOR PRODUCING A LIQUID COMPOSITION UNIV LIVERPOOL (GB) 2020-04-16 US claimed
EP-0656965-B1 LOW FUME FINISH FOR WET AIT-JET TEXTURING DU PONT (US) 1996-04-17 EP claimed
EP-0746342-A4 BIODEGRADABLE CONTROLLED RELEASE MELT-SPUN DELIVERY SYSTEM FUISZ TECHNOLOGIES LTD (US) 1996-01-11 EP claimed
WO-1995017174-A1 PROCESS FOR MAKING LAXATIVES CONTAINING DIOCTYL SULFOSUCCINATE THE PROCTER & GAMBLE COMPANY (US) 1995-06-29 WO claimed
EP-0656965-A1 LOW FUME FINISH FOR WET AIT-JET TEXTURING. DU PONT (US) 1995-06-14 EP claimed
US-5350529-A Polyoxyethylene nonionic emulsifier, ester, anionic surfactant E. I. DU PONT DE NEMOURS AND COMPANY (US) 1994-09-27 US claimed
WO-1994005847-A1 LOW FUME FINISH FOR WET AIT-JET TEXTURING E.I. DU PONT DE NEMOURS AND COMPANY (US) 1994-03-17 WO claimed
WO-1993024154-A1 BIODEGRADABLE CONTROLLED RELEASE MELT-SPUN DELIVERY SYSTEM FUISZ TECHNOLOGIES, LTD. (US) 1993-12-09 WO claimed
US-4196200-A COMPLEXING, FEEDS AMERICAN CYANAMID COMPANY (US) 1980-04-01 US claimed
EP-0003644-A1 Animal feed supplements containing antibiotic trans-BM 123-gamma and process for making same AMERICAN CYANAMID COMPANY (US) 1979-08-22 EP claimed
US-4075134-A EMULSION POLYMERIZATION METHOD FOR PREPARING MICROSPHERES HAVING LIQUID CENTER AND SEAMLESS RIGID WALLS THE DOW CHEMICAL COMPANY (US) 1978-02-21 US claimed

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-20200114012-A1 METHOD FOR PRODUCING A LIQUID COMPOSITION LIPA, LIPC, CEL RECQL 2942/4885CYP3A4 1748/4885TSHR 4689/4885
US-20210361663-A1 Formulations of Antiviral Compounds GYS2, VIM, WARS1 RECQL 261/4885CYP3A4 82/4885TSHR 4758/4885

“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.