SCHEMBL5402167

SCHEMBL5402167

CCOC(=O)C(C)N.O=S(=O)(O)c1ccc(Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.52
CA12 O43570 3/20 0.50
CA1 P00915 3/20 0.50
CA2 P00918 3/20 0.50
CA9 Q16790 3/20 0.50
GRIN2D O15399 1/20 0.50
GRIN3B O60391 1/20 0.50
GRIN1 Q05586 1/20 0.50
GRIN2A Q12879 1/20 0.50
GRIN2B Q13224 1/20 0.50
GRIN2C Q14957 1/20 0.50
GRIN3A Q8TCU5 1/20 0.50
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
CYP3A4 P08684 4/20 0.46
CYP1A2 P05177 3/20 0.46
CYP2D6 P10635 3/20 0.46
CYP2C19 P33261 3/20 0.46
CYP2C9 P11712 2/20 0.46
NFKB1 P19838 1/20 0.46

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
SCHEMBL5399851 1.00 POLB (0.52) POLBCA12CA1CA2CA9
SCHEMBL5407485 0.88 CYP1A2 (0.48) CA12CA1CA2CA9MEN1
SCHEMBL5403997 0.88 CYP1A2 (0.48) CA12CA1CA2CA9MEN1
SCHEMBL5392843 0.85 LMNA (0.46) CA12CA1CA2CA9MEN1
SCHEMBL5392841 0.85 LMNA (0.46) CA12CA1CA2CA9MEN1
SCHEMBL5405829 0.85 TSHR (0.50) POLBCA12CA1CA2CA9
SCHEMBL5407602 0.85 TSHR (0.50) POLBCA12CA1CA2CA9
Alanine SCHEMBL9710982 0.81 SLC1A3 (0.50) CA12CA1CA2CA9CYP3A4
Alanine SCHEMBL11034209 0.81 SLC1A3 (0.50) CA12CA1CA2CA9CYP3A4
Sulfuric Acid SCHEMBL10354951 0.77 TP53 (0.47) CA12CA1CA2CA9GRIN2D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7205433-B2 Crystal of amino acid ester salt and process for producing the same AJINOMOTO CO., INC. (JP) 2007-04-17 US disclosed
US-20050197396-A1 Crystal of amino acid ester salt and process for producing the same AJINOMOTO CO. INC (JP) 2005-09-08 US disclosed
EP-1541546-A1 CRYSTAL OF AMINO ACID ESTER SALT AND PROCESS FOR PRODUCING THE SAME Ajinomoto Co., Inc. (JP) 2005-06-15 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-20050197396-A1 Crystal of amino acid ester salt and process for producing the same SLC43A1, AAAS, AARS1 POLB 3473/4885CA12 195/4885CA1 107/4885

“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.