SCHEMBL1024150

SCHEMBL1024150

CC(C)(C)OC(=O)N[C@@H](CCCNC(=O)OCc1ccccc1)CC(=O)O

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.62
SYK P43405 1/20 0.58
HTT P42858 1/20 0.54
KLK7 P49862 2/20 0.53
KLK5 Q9Y337 2/20 0.53
ITGB3 P05106 1/20 0.51
ITGA2B P08514 1/20 0.51
FOLH1 Q04609 4/20 0.50
ATM Q13315 1/20 0.47
LMNA P02545 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
TGM2 P21980 1/20 0.46

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
SCHEMBL16279057 1.00 MAPT (0.62) MAPTSYKHTTKLK7KLK5
SCHEMBL1022850 0.97 MAPT (0.66) MAPTSYKHTTKLK7KLK5
SCHEMBL1021955 0.96 SYK (0.64) MAPTSYKHTTKLK7KLK5
SCHEMBL6372820 0.93 SYK (0.60) MAPTSYKHTTKLK7KLK5
SCHEMBL6372825 0.93 SYK (0.60) MAPTSYKHTTKLK7KLK5
SCHEMBL20556374 0.93 SYK (0.63) MAPTSYKHTTKLK7KLK5
SCHEMBL20556328 0.93 SYK (0.63) MAPTSYKHTTKLK7KLK5
SCHEMBL19345775 0.93 SYK (0.63) MAPTSYKHTTKLK7KLK5
SCHEMBL4883784 0.90 MAPT (0.61) MAPTSYKHTTKLK7KLK5
SCHEMBL21789935 0.90 MAPT (0.63) MAPTSYKHTTKLK7KLK5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9371274-B2 Compound having read-through activity THE UNIVERSITY OF TOKYO (JP) 2016-06-21 US disclosed
US-9371274-B2 Compound having read-through activity THE UNIVERSITY OF TOKYO (JP) 2016-06-21 US disclosed
US-20140364642-A1 COMPOUND HAVING READ-THROUGH ACTIVITY THE UNIVERSITY OF TOKYO (JP) 2014-12-11 US disclosed
US-20140364642-A1 COMPOUND HAVING READ-THROUGH ACTIVITY THE UNIVERSITY OF TOKYO (JP) 2014-12-11 US disclosed
EP-1797110-B1 ANTIBACTERIAL AMIDE MACROCYCLES IV AICURIS GMBH & CO KG (DE) 2011-01-12 EP disclosed
US-20080275018-A1 ANTIBACTERIAL AMIDE-MACROCYCLES V AICURIS GMBH & CO. KG (DE) 2008-11-06 US disclosed
US-7446102-B2 Antibacterial amide macrocycles IV AICURIS GMBH & CO. KG (DE) 2008-11-04 US disclosed
US-20080076745-A1 ANTIBACTERIAL AMIDE MACROCYCLES IV AICURIS GMBH & CO. KG (DE) 2008-03-27 US disclosed
US-20080076824-A1 modified glycinamides: Valine-alphahydroxy-glycinamide CHRONTECH PHARMA AB (SE) 2008-03-27 US disclosed
US-20080076824-A1 modified glycinamides: Valine-alphahydroxy-glycinamide CHRONTECH PHARMA AB (SE) 2008-03-27 US disclosed
EP-1797110-A1 ANTIBACTERIAL AMIDE MACROCYCLES IV AiCuris GmbH & Co. KG (DE) 2007-06-20 EP disclosed
WO-2006034786-A1 ANTIBACTERIAL AMIDE MACROCYCLES IV AICURIS GMBH & CO.KG (DE) 2006-04-06 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 (4 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-20080076745-A1 ANTIBACTERIAL AMIDE MACROCYCLES IV NOD2, AAAS, AADAC MAPT 4356/4885SYK 3060/4885HTT 1796/4885
US-20080076824-A1 modified glycinamides: Valine-alphahydroxy-glycinamide GALE, ENGASE, UGGT1 MAPT 2849/4885SYK 3178/4885HTT 409/4885
US-20080275018-A1 ANTIBACTERIAL AMIDE-MACROCYCLES V ARG1, HRH3, H1-0 MAPT 4840/4885SYK 2058/4885HTT 1449/4885
US-20140364642-A1 COMPOUND HAVING READ-THROUGH ACTIVITY UPF1, NUDT21, GBA2 MAPT 3268/4885SYK 4808/4885HTT 147/4885

“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.