SCHEMBL7804077

SCHEMBL7804077

CCCCC(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.47
CA1 P00915 3/20 0.47
CTSK P43235 12/20 0.44
MAPK1 P28482 1/20 0.42
CTSS P25774 1/20 0.42

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
SCHEMBL28926772 0.93 CA1 (0.55) CA2CA1CTSKCTSS
SCHEMBL27343844 0.92 CA2 (0.48) CA2CA1CTSKMAPK1CTSS
SCHEMBL7804092 0.92 CA2 (0.48) CA2CA1CTSKMAPK1CTSS
SCHEMBL17377641 0.92 ZDHHC7 (0.46) CA2CA1
SCHEMBL8490442 0.92 ZDHHC7 (0.46) CA2CA1
SCHEMBL28311243 0.91 ALDH1A1 (0.42) CA2CA1CTSKMAPK1CTSS
SCHEMBL27817034 0.91 CA2 (0.41) CA2CA1CTSKMAPK1CTSS
SCHEMBL27395164 0.91 CA2 (0.41) CA2CA1CTSKMAPK1CTSS
SCHEMBL29021012 0.89 CA2 (0.42) CA2CA1CTSKMAPK1CTSS
SCHEMBL3325978 0.87 CTSK (0.39) CA2CA1CTSKCTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150316849-A1 RESIST UNDERLAYER FILM FORMING COMPOSITION CONTAINING SILICON HAVING ESTER GROUP NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2015-11-05 US disclosed
US-20110257434-A1 PERTURBED MEMBRANE-BINDING COMPOUNDS AND METHODS OF USING THE SAME APOSENSE LTD. (IL) 2011-10-20 US disclosed
US-20110257434-A1 PERTURBED MEMBRANE-BINDING COMPOUNDS AND METHODS OF USING THE SAME APOSENSE LTD. (IL) 2011-10-20 US disclosed
US-7947253-B2 compounds such as 2-methyl-2(3-fluoropropyl)-malonic Acid that selectively bind to cells undergoing perturbations and alterations of their normal plasma membrane organization, i.e., cells undergoing cell death, apoptotic cells or activated platelets APOSENSE LTD. (IL) 2011-05-24 US disclosed
US-7947253-B2 compounds such as 2-methyl-2(3-fluoropropyl)-malonic Acid that selectively bind to cells undergoing perturbations and alterations of their normal plasma membrane organization, i.e., cells undergoing cell death, apoptotic cells or activated platelets APOSENSE LTD. (IL) 2011-05-24 US disclosed
US-7670590-B2 Perturbed membrane-binding compounds and methods of using the same APOSENSE LTD. (IL) 2010-03-02 US disclosed
US-7670590-B2 Perturbed membrane-binding compounds and methods of using the same APOSENSE LTD. (IL) 2010-03-02 US disclosed
US-20080279774-A1 Perturbed Membrane-Binding Compounds And Methods Of Using The Same NST NEUOROSURIVAL TECHNOLOGIES LTD. (IL) 2008-11-13 US disclosed
US-20080279774-A1 Perturbed Membrane-Binding Compounds And Methods Of Using The Same NST NEUOROSURIVAL TECHNOLOGIES LTD. (IL) 2008-11-13 US disclosed
US-20080014148-A1 Perturbed membrane-binding compounds and methods of using the same APOSENSE LTD. (IL) 2008-01-17 US disclosed
US-20080014148-A1 Perturbed membrane-binding compounds and methods of using the same APOSENSE LTD. (IL) 2008-01-17 US disclosed
US-7270799-B2 Perturbed membrane-binding compounds and methods of using the same NST NEUROSURVIVAL TECHNOLOGIES LTD. (IL) 2007-09-18 US disclosed
US-7270799-B2 Perturbed membrane-binding compounds and methods of using the same NST NEUROSURVIVAL TECHNOLOGIES LTD. (IL) 2007-09-18 US disclosed
EP-1130469-A1 A radiation-sensitive resist material and a process for device fabrication using the same LUCENT TECHNOLOGIES INC. (US) 2001-09-05 EP 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 (3 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-20110257434-A1 PERTURBED MEMBRANE-BINDING COMPOUNDS AND METHODS OF USING THE SAME ANXA5, SELPLG, ANXA6 CA2 1675/4885CA1 2966/4885CTSK 1802/4885
US-20080014148-A1 Perturbed membrane-binding compounds and methods of using the same ANXA5, SELPLG, ANXA6 CA2 1722/4885CA1 3098/4885CTSK 1783/4885
US-20080279774-A1 Perturbed Membrane-Binding Compounds And Methods Of Using The Same ANXA5, SELPLG, ANXA6 CA2 1722/4885CA1 3098/4885CTSK 1783/4885

“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.