SCHEMBL2959618

SCHEMBL2959618

CC(C)(C)C(=O)OCOC(=O)NCCCP(=O)(O)CC1CCCCC1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 6/20 0.34
HRH3 Q9Y5N1 6/20 0.34
ENO1 P06733 1/20 0.33
GHSR Q92847 1/20 0.33
EPHX1 P07099 2/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP3 P08254 1/20 0.33
MMP9 P14780 1/20 0.33
MMP8 P22894 1/20 0.33
CA9 Q16790 1/20 0.33
EPHX2 P34913 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
NAAA Q02083 2/20 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
SCHEMBL2957743 0.85 MMP8 (0.33) HRH4HRH3GHSRCA12CA1
SCHEMBL2956632 0.84 EPHX2 (0.38) EPHX1CA12CA1CA2MMP1
SCHEMBL2947853 0.84 CA12 (0.34) HRH4HRH3EPHX1CA12CA1
SCHEMBL2957645 0.82 CTSK (0.36) HRH4HRH3GHSREPHX1CA12
SCHEMBL2957939 0.82 ENO1 (0.33) ENO1CA12CA1CA2MMP1
SCHEMBL2949220 0.80 METAP1 (0.33) ENO1
SCHEMBL2958738 0.79 ACHE (0.44) EPHX1MMP2
SCHEMBL2956004 0.79 METAP1 (0.33) ENO1
SCHEMBL1881136 0.78 ACHE (0.37)
SCHEMBL2954877 0.77 HRH4 (0.40) HRH4HRH3EPHX1CA12CA1

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-7585996-B2 Acyloxyalkyl carbamate prodrugs, methods of synthesis and use XENOPORT, INC. (US) 2009-09-08 US claimed
US-7749985-B2 Acyloxyalkyl carbamate prodrugs, methods of synthesis and use XENOPORT, INC. (US) 2010-07-06 US disclosed
US-20090286759-A1 ACYLOXYALKYL CARBAMATE PRODRUGS, METHODS OF SYNTHESIS AND USE XENOPORT, INC. (US) 2009-11-19 US disclosed
US-7585996-B2 Acyloxyalkyl carbamate prodrugs, methods of synthesis and use XENOPORT, INC. (US) 2009-09-08 US disclosed
US-20080146526-A1 Acyloxyalkyl carbamate prodrugs, methods of synthesis and use XENOPORT, INC. 2008-06-19 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-20090286759-A1 ACYLOXYALKYL CARBAMATE PRODRUGS, METHODS OF SYNTHESIS AND USE APEH, NAPEPLD, AASDHPPT HRH4 1225/4885HRH3 1291/4885ENO1 2454/4885
US-20080146526-A1 Acyloxyalkyl carbamate prodrugs, methods of synthesis and use APEH, NAPEPLD, AASDHPPT HRH4 1225/4885HRH3 1291/4885ENO1 2454/4885

“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.