Diethyl Hydrogen Phosphate

Diethyl Hydrogen Phosphate

SCHEMBL5202113

C#N.CCOP(=O)(O)OCC.O=P(O)(Oc1ccccc1)Oc1ccccc1.[N-]=[N+]=N

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
SRC P12931 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.39
TSHR P16473 1/20 0.38
POLB P06746 1/20 0.37
ANPEP P15144 1/20 0.37
LAP3 P28838 1/20 0.37
NPSR1 Q6W5P4 1/20 0.36
NR1I2 O75469 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA4 P22748 1/20 0.36
CA5A P35218 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CA5B Q9Y2D0 1/20 0.36
KCNH2 Q12809 1/20 0.36
LMNA P02545 1/20 0.35
CYP2C9 P11712 1/20 0.35

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
SCHEMBL59584 0.83 SRC (0.57) ALDH1A1SRCL3MBTL1TSHRPOLB
SCHEMBL385577 0.82 ALDH1A1 (0.58) ALDH1A1SRCL3MBTL1TSHRPOLB
SCHEMBL27876409 0.80 ALDH1A1 (0.45) ALDH1A1SRCL3MBTL1POLBANPEP
Alcohol SCHEMBL28173306 0.79 SRC (0.52) ALDH1A1SRCL3MBTL1POLBANPEP
Cyanide SCHEMBL11224902 0.78 SRC (0.64) ALDH1A1SRCL3MBTL1TSHRPOLB
Biphenyl SCHEMBL924817 0.77 ALDH1A1 (0.54) ALDH1A1SRCL3MBTL1TSHRPOLB
SCHEMBL734215 0.77 SRC (0.61) ALDH1A1SRCL3MBTL1TSHRPOLB
SCHEMBL21647518 0.77 SRC (0.61) ALDH1A1SRCL3MBTL1TSHRPOLB
SCHEMBL28799872 0.77 SRC (0.61) ALDH1A1SRCL3MBTL1TSHRPOLB
Diethyl Hydrogen Phosphate SCHEMBL2644841 0.76 TSHR (0.42) TSHRCA12CA1CA2CA9

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070299114-A1 Biaryl Derivatives SHIONOGI & CO., LTD. (JP) 2007-12-27 US disclosed
EP-1798224-A1 BIARYL DERIVATIVE Shionogi Co., Ltd. (JP) 2007-06-20 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 (1 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-20070299114-A1 Biaryl Derivatives CBR3, NR1H4, CBR1 ALDH1A1 2267/4885SRC 2327/4885L3MBTL1 3455/4885

“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.