SCHEMBL1887816

SCHEMBL1887816

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nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACHE P22303 8/20 0.33
GABBR2 O75899 1/20 0.33
CYP1A2 P05177 1/20 0.33
TSHR P16473 1/20 0.33
THPO P40225 1/20 0.33
GABBR1 Q9UBS5 1/20 0.33
ALOX15 P16050 1/20 0.32
LMNA P02545 1/20 0.32
BLM P54132 1/20 0.32
TLR2 O60603 2/20 0.30
CHRNB2 P17787 2/20 0.30
CHRNB4 P30926 2/20 0.30
CHRNA3 P32297 2/20 0.30
CHRNA4 P43681 2/20 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
SCHEMBL1887424 1.00 ACHE (0.33) ACHEGABBR2CYP1A2TSHRTHPO
SCHEMBL1886924 1.00 ACHE (0.33) ACHEGABBR2CYP1A2TSHRTHPO
SCHEMBL1885982 0.87 ACHE (0.33) ACHEGABBR2CYP1A2TSHRTHPO
SCHEMBL2947826 0.85 ACHE (0.40) ACHEGABBR2GABBR1ALOX15
SCHEMBL2948819 0.85 ACHE (0.40) ACHEGABBR2GABBR1ALOX15
SCHEMBL2954950 0.85 ACHE (0.40) ACHEGABBR2GABBR1ALOX15
SCHEMBL2945997 0.84 ACHE (0.39) ACHEGABBR2GABBR1ALOX15
SCHEMBL2955225 0.80 MMP1 (0.38) ACHEALOX15CHRNB2CHRNB4CHRNA3
SCHEMBL1884738 0.79 ACHE (0.38) ACHEGABBR2CYP1A2TSHRTHPO
SCHEMBL1881748 0.79 CHRNB2 (0.32) CHRNB2CHRNB4CHRNA3CHRNA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7935686-B2 Acyloxyalkyl carbamate prodrugs, methods of synthesis, and use XENOPORT, INC. (US) 2011-05-03 US disclosed
US-20090124582-A1 Acyloxyalkyl Carbamate Prodrugs, Methods of Synthesis, and Use XENOPORT, INC. (US) 2009-05-14 US disclosed
US-7494985-B2 Acyloxyalkyl carbamate prodrugs, methods of synthesis, and use XENOPORT, INC. (US) 2009-02-24 US disclosed
US-20060111325-A1 Acyloxyalkyl carbamate prodrugs, methods of synthesis, and use XENOPORT, INC. 2006-05-25 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 (2 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-20060111325-A1 Acyloxyalkyl carbamate prodrugs, methods of synthesis, and use APEH, AASDHPPT, AGPS ACHE 178/4885GABBR2 388/4885CYP1A2 2232/4885
US-20090124582-A1 Acyloxyalkyl Carbamate Prodrugs, Methods of Synthesis, and Use APEH, AASDHPPT, AGPS ACHE 178/4885GABBR2 388/4885CYP1A2 2232/4885

“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.