Diethyl Hydrogen Phosphate

Diethyl Hydrogen Phosphate

SCHEMBL2788463

CCOP(=O)(O)OCC.CCSC(=N)N

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 3/20 0.58
NOS1 P29475 3/20 0.58
NOS2 P35228 3/20 0.58
TSHR P16473 3/20 0.58
CYP1A2 P05177 2/20 0.58
CYP2C19 P33261 2/20 0.58
CYP2D6 P10635 1/20 0.58
TDP1 Q9NUW8 2/20 0.56
BLM P54132 1/20 0.56
PPARD Q03181 2/20 0.35
LMNA P02545 2/20 0.35
HRH4 Q9H3N8 2/20 0.34
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
IDO1 P14902 1/20 0.32
TP53 P04637 1/20 0.32

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
Diethyl Hydrogen Phosphate SCHEMBL28772823 0.95 NOS3 (0.52) NOS3NOS1NOS2TSHRCYP1A2
Diethyl Hydrogen Phosphate SCHEMBL8410487 0.79 TSHR (0.40) TSHRTDP1PPARDTP53
Diethyl Hydrogen Phosphate SCHEMBL27873282 0.76 PPARD (0.38) TSHRCYP2C19CYP2D6TDP1PPARD
Diethyl Hydrogen Phosphate SCHEMBL27294237 0.76 TSHR (0.56) TSHRTDP1PPARDTP53
Diethyl Hydrogen Phosphate SCHEMBL93056 0.76
Ethylisothiourea SCHEMBL160501 0.76
Diethyl Hydrogen Phosphate SCHEMBL27873286 0.74 TSHR (0.43) TSHRCYP2C19CYP2D6TDP1BLM
Diethyl Hydrogen Phosphate SCHEMBL16552927 0.74 TSHR (0.43) TSHRTDP1PPARDTP53
SCHEMBL20524263 0.74 NOS1 (0.43) NOS3NOS1NOS2TSHRCYP1A2
Diethyl Hydrogen Phosphate SCHEMBL11752938 0.73 TSHR (0.53) TSHRTDP1PPARDTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12011423-B2 S-alkylisothiouronium derivatives for treating uterine hypercontractility disorders FORAVISET LTD. (IL) 2024-06-18 US claimed
CN-116685302-A Topical compositions 利勒格有限公司 2023-09-01 CN claimed
US-20200360313-A1 S-ALKYLISOTHIOURONIUM DERIVATIVES FOR TREATING UTERINE HYPERCONTRACTILITY DISORDERS FORAVISET LTD (IL) 2020-11-19 US claimed
US-20180318238-A1 METHODS FOR REDUCING SEQUELAE OF INTRA-DIALYTIC HYPOTENSION FARFARA ROY (CY) 2018-11-08 US claimed
WO-2017072776-A1 METHODS FOR REDUCING SEQUELAE OF INTRA-DIALYTIC HYPOTENSION FARFARA ROY (CY) 2017-05-04 WO claimed
US-8673979-B2 Pharmaceutical compositions for headache, migraine, nausea and emesis MEDITOR PHARMACEUTICALS LTD. (IL) 2014-03-18 US claimed
EP-2219447-B1 S-ALKYLISOTHIOURONIUM DERIVATIVES FOR TREATING UTERINE HYPERCONTRACTILITY DISORDERS BARKAN FARMA S R L (MD) 2013-07-03 EP claimed
US-20100311691-A1 COMPOSITIONS OF S-ALKYLISOTHIOURONIUM DERIVATIVES FOR TREATING UPPER RESPIRATORY CONGESTION BARKAN REFAEL 2010-12-09 US claimed
US-20100305210-A1 S-ALKYLISOTHIOURONIUM DERIVATIVES FOR TREATING ABNORMAL UTERINE BLEEDING DISORDERS BARKAN-FARMA S.R.L. (MD) 2010-12-02 US claimed
US-20100285127-A1 TASTE MASKED PHARMACEUTICAL COMPOSITIONS OF S-ALKYLISOTHIOURONIUM DERIVATIVES MEDITOR PHARMACEUTICALS LTD. (IL) 2010-11-11 US claimed
WO-2007029255-A1 PREVENTION OF HYPOTENSION AND STABILIZATION OF BLOOD PRESSURE IN HEMODIALYSIS PATIENTS MEDITOR PHARMACEUTICALS LTD. (IL) 2007-03-15 WO claimed
US-7148208-B2 Pharmaceutical compositions for headache, migraine, nausea and emesis MEDITOR PHARMACEUTICALS LTD. (IL) 2006-12-12 US claimed
EP-1315505-A4 PHARMACEUTICAL COMPOSITIONS FOR HEADACHE, MIGRAINE, NAUSEA AND EMESIS MEDITOR PHARMACEUTICALS LTD (IL) 2006-02-22 EP claimed
US-20040006044-A1 Pharmaceutical compositions for headache, migraine, nausea and emesis MEDITOR PHARMACEUTICALS LTD. (IL) 2004-01-08 US claimed
EP-1315505-A2 PHARMACEUTICAL COMPOSITIONS FOR HEADACHE, MIGRAINE, NAUSEA AND EMESIS Meditor Pharmaceuticals Ltd. (IL) 2003-06-04 EP claimed
EP-0928191-B1 PHARMACEUTICAL COMPOSITIONS COMPRISING S-ALKYLISOTHIOURONIUM DERIVATIVES MEDITOR PHARMACEUTICALS LTD (IL) 2002-08-28 EP claimed
WO-2002019961-A2 PHARMACEUTICAL COMPOSITIONS FOR HEADACHE, MIGRAINE, NAUSEA AND EMESIS MEDITOR PHARMACEUTICALS LTD. (IL) 2002-03-14 WO claimed
US-6160008-A Pharmaceutical compositions comprising S-alkylisothiouronium derivatives MEDITOR PHARMACEUTICALS LTD. (IL) 2000-12-12 US claimed
EP-0928191-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING S-ALKYLISOTHIOURONIUM DERIVATIVES Meditor Pharmaceuticals Ltd. (IL) 1999-07-14 EP claimed
WO-1998013036-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING S-ALKYLISOTHIOURONIUM DERIVATIVES MEDITOR PHARMACEUTICALS LTD. (IL) 1998-04-02 WO 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 (7 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-20200360313-A1 S-ALKYLISOTHIOURONIUM DERIVATIVES FOR TREATING UTERINE HYPERCONTRACTILITY DISORDERS KCNN3, ITPR3, KCNN2 NOS3 1664/4885NOS1 2826/4885NOS2 2377/4885
US-20180318238-A1 METHODS FOR REDUCING SEQUELAE OF INTRA-DIALYTIC HYPOTENSION REN, SLC6A5, SLC6A12 NOS3 1108/4885NOS1 1882/4885NOS2 1042/4885
US-20100311691-A1 COMPOSITIONS OF S-ALKYLISOTHIOURONIUM DERIVATIVES FOR TREATING UPPER RESPIRATORY CONGESTION H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, TAS2R7, ADRB1 NOS3 1091/4885NOS1 1481/4885NOS2 1507/4885
US-20100285127-A1 TASTE MASKED PHARMACEUTICAL COMPOSITIONS OF S-ALKYLISOTHIOURONIUM DERIVATIVES TAS2R5, TAS2R40, TAS2R30 NOS3 2946/4885NOS1 3835/4885NOS2 3695/4885
US-12011423-B2 S-alkylisothiouronium derivatives for treating uterine hypercontractility disorders KCNN3, ITPR3, KCNN2 NOS3 1664/4885NOS1 2826/4885NOS2 2377/4885
US-20100305210-A1 S-ALKYLISOTHIOURONIUM DERIVATIVES FOR TREATING ABNORMAL UTERINE BLEEDING DISORDERS ITPR3, KCNN3, KCNN2 NOS3 1731/4885NOS1 3072/4885NOS2 2431/4885
US-20040006044-A1 Pharmaceutical compositions for headache, migraine, nausea and emesis MGMT, TRPA1, HNMT NOS3 1855/4885NOS1 2729/4885NOS2 2383/4885

“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.