SCHEMBL967598

SCHEMBL967598

CCCCCCCCCCCCCCC(CCCCCCCCCCCCCC)C(=O)OC

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.70
CA1 P00915 1/20 0.70
ZDHHC7 Q9NXF8 1/20 0.66
BIRC2 Q13490 5/20 0.51
ABCB1 P08183 1/20 0.50
USP2 O75604 1/20 0.49
LMNA P02545 1/20 0.49
GRIK1 P39086 2/20 0.47
GRIK2 Q13002 2/20 0.47
GPR84 Q9NQS5 3/20 0.47
FFAR1 O14842 1/20 0.47
MAPT P10636 1/20 0.45
EPHX1 P07099 1/20 0.45
LCK P06239 1/20 0.45
PPARD Q03181 1/20 0.45
ZDHHC20 Q5W0Z9 1/20 0.45
ZDHHC2 Q9UIJ5 1/20 0.45
SLC1A2 P43004 1/20 0.44
SLC1A1 P43005 1/20 0.44
PLA2G2A P14555 1/20 0.44

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
SCHEMBL19522393 1.00 CA2 (0.70) CA2CA1ZDHHC7BIRC2ABCB1
SCHEMBL16950292 1.00 CA2 (0.70) CA2CA1ZDHHC7BIRC2ABCB1
SCHEMBL18597131 1.00 CA2 (0.70) CA2CA1ZDHHC7BIRC2ABCB1
SCHEMBL18429981 1.00 CA2 (0.70) CA2CA1ZDHHC7BIRC2ABCB1
SCHEMBL21356697 1.00 CA2 (0.70) CA2CA1ZDHHC7BIRC2ABCB1
SCHEMBL17199802 1.00 CA2 (0.70) CA2CA1ZDHHC7BIRC2ABCB1
SCHEMBL21356682 1.00 CA2 (0.70) CA2CA1ZDHHC7BIRC2ABCB1
SCHEMBL21356686 1.00 CA2 (0.70) CA2CA1ZDHHC7BIRC2ABCB1
SCHEMBL21356695 1.00 CA2 (0.70) CA2CA1ZDHHC7BIRC2ABCB1
SCHEMBL5590767 1.00 CA2 (0.70) CA2CA1ZDHHC7BIRC2ABCB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2271661-B3 Derivatives of muramylpeptide IMUTHES LTD (GB) 2014-08-20 EP disclosed
US-8653049-B2 Normuramyl glycopeptide compounds IMUTHES LIMITED (GB) 2014-02-18 US disclosed
EP-2578598-A1 Componds derived from normuramyldipeptide IMUTHES LIMITED (GB) 2013-04-10 EP disclosed
EP-2271661-B1 Derivatives of muramylpeptide IMUTHES LTD (GB) 2013-02-27 EP disclosed
EP-2271661-A2 COMPOUNDS DERIVED FROM MURAMYLDIPEPTIDE IMUTHES LIMITED (GB) 2011-01-12 EP disclosed
US-20110002983-A1 COMPOUND IMUTHES LIMITED (GB) 2011-01-06 US disclosed
WO-2009115782-A2 COMPOUND IMUTHES LIMITED (GB) 2009-09-24 WO disclosed
US-5589465-A Glycolipid derivatives acting as ligands for selectins Hasegawa, Akira (JP) 1996-12-31 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-20110002983-A1 COMPOUND C5AR1, C5AR2, ARG1 CA2 1291/4885CA1 605/4885ZDHHC7 247/4885

“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.