SCHEMBL5824315

SCHEMBL5824315

C=CC(=O)NC(CC)OCC(O)CO

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.39
KDM4E B2RXH2 1/20 0.33
DUSP3 P51452 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 1/20 0.33
DGKA P23743 1/20 0.32
ACACB O00763 2/20 0.32
CYP2C19 P33261 1/20 0.31
FAAH O00519 2/20 0.31
USP2 O75604 1/20 0.30
ZDHHC20 Q5W0Z9 1/20 0.30
ZDHHC2 Q9UIJ5 1/20 0.30
PLA2G2C Q5R387 1/20 0.30

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
SCHEMBL6580192 0.80 TSHR (0.47) TSHRACACBCYP2C19ZDHHC20ZDHHC2
SCHEMBL660975 0.75 TSHR (0.45) TSHRACACBCYP2C19ZDHHC20ZDHHC2
SCHEMBL5207256 0.74 TSHR (0.48) TSHRACACBCYP2C19ZDHHC20ZDHHC2
SCHEMBL5382265 0.72 MEN1 (0.54) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL18124154 0.71 TSHR (0.50) TSHRACACBCYP2C19ZDHHC20ZDHHC2
Glycerin SCHEMBL27971473 0.71 TSHR (0.72) TSHRMEN1KMT2ALMNAACACB
SCHEMBL28257876 0.70 TSHR (0.44) TSHRACACBCYP2C19ZDHHC20ZDHHC2
SCHEMBL10487230 0.70 TSHR (0.48) TSHRACACBCYP2C19ZDHHC20ZDHHC2
SCHEMBL11316755 0.70 TSHR (0.46) TSHRACACBCYP2C19ZDHHC20ZDHHC2
SCHEMBL1303579 0.70 ALDH1A1 (0.37) TSHRACACB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050113539-A1 Crosslinked, water insoluble matrix; electrophoresis membranes GE HEALTHCARE BIO-SCIENCES AB (SE) 2005-05-26 US claimed
WO-2003055923-A1 NOVEL MONOMERS USEFUL IN THE PREPARATION OF SEPARATION MATRICES AMERSHAM BIOSCIENCES AB (SE) 2003-07-10 WO claimed
US-7060776-B2 Monomers useful in the preparation of separation matrices GE HEALTHCARE BIO-SCIENCES AB (SE) 2006-06-13 US disclosed
US-20050113539-A1 Crosslinked, water insoluble matrix; electrophoresis membranes GE HEALTHCARE BIO-SCIENCES AB (SE) 2005-05-26 US disclosed
WO-2003055923-A1 NOVEL MONOMERS USEFUL IN THE PREPARATION OF SEPARATION MATRICES AMERSHAM BIOSCIENCES AB (SE) 2003-07-10 WO 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-20050113539-A1 Crosslinked, water insoluble matrix; electrophoresis membranes H1-0, H1-4, H1-2 TSHR 3304/4885KDM4E 943/4885DUSP3 4418/4885

“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.