SCHEMBL19685576

SCHEMBL19685576

N[C@@H](Cn1ccc(=O)c(O)c1)C(=O)OS

nearest known ligand 0.69

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TYR P14679 3/20 0.69
KDM4E B2RXH2 2/20 0.69
DOHH Q9BU89 1/20 0.69
CA12 O43570 5/20 0.36
CA1 P00915 5/20 0.36
CA2 P00918 5/20 0.36
CA9 Q16790 5/20 0.36
COMT P21964 1/20 0.33
MAOB P27338 1/20 0.32
CYP1A2 P05177 1/20 0.31
GRIA1 P42261 1/20 0.31
GRIA2 P42262 1/20 0.31
GRIA3 P42263 1/20 0.31
GRIA4 P48058 1/20 0.31
GRIK5 Q16478 1/20 0.31

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
SCHEMBL19679887 0.86 TYR (0.69) TYRKDM4EDOHHCA12CA1
L-Mimosine SCHEMBL11895399 0.82 TYR (1.00) TYRKDM4EDOHHCA12CA1
Mimosine SCHEMBL41924 0.82 TYR (1.00) TYRKDM4EDOHHCA12CA1
L-Mimosine SCHEMBL41925 0.82 TYR (1.00) TYRKDM4EDOHHCA12CA1
Mimosine SCHEMBL9878748 0.81 TYR (0.97) TYRKDM4EDOHHCA12CA1
L-Mimosine SCHEMBL1720110 0.81 TYR (0.97) TYRKDM4EDOHHCA12CA1
Mimosine SCHEMBL1720107 0.81 TYR (0.97) TYRKDM4EDOHHCA12CA1
L-Mimosine SCHEMBL9878752 0.79 TYR (0.73) TYRKDM4EDOHHCA12CA1
L-Mimosine SCHEMBL2164631 0.79 TYR (0.94) TYRKDM4EDOHHCA12CA1
Mimosine SCHEMBL2164625 0.79 TYR (0.94) TYRKDM4EDOHHCA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170349548-A1 P21-ACTIVATED KINASE INHIBITOR BIOSYSTEM CONSULTING LIMITED COMPANY (JP) 2017-12-07 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 (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-20170349548-A1 P21-ACTIVATED KINASE INHIBITOR HIPK1, CDKN1A, HIPK2 TYR 1687/4885KDM4E 3247/4885DOHH 2061/4885

“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.