SCHEMBL1022650

SCHEMBL1022650

CC(C)(C)OC(=O)NC(CC(CNC(=O)OCc1ccccc1)O[Si](C)(C)C(C)(C)C)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.53
PPARA Q07869 3/20 0.50
MAPT P10636 1/20 0.49
PPARG P37231 2/20 0.46
CTSS P25774 5/20 0.46
CTSK P43235 4/20 0.45
KLK7 P49862 3/20 0.45
KLK5 Q9Y337 3/20 0.45
ACE P12821 1/20 0.45
CTSL P07711 2/20 0.44
CTSB P07858 2/20 0.44
ITGB3 P05106 1/20 0.43
ITGA2B P08514 1/20 0.43
CAPN1 P07384 1/20 0.43
CAPN2 P17655 1/20 0.43

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
SCHEMBL1022651 1.00 SYK (0.53) SYKPPARAMAPTPPARGCTSS
SCHEMBL30500895 0.88 SYK (0.60) SYKPPARAMAPTCTSSCTSK
SCHEMBL1020968 0.86 SYK (0.45) SYKMAPTCTSSCTSKKLK7
SCHEMBL1022494 0.83 SYK (0.65) SYKPPARAMAPTPPARGCTSS
SCHEMBL17841824 0.83 SYK (0.65) SYKPPARAMAPTPPARGCTSS
SCHEMBL606625 0.83 SYK (0.65) SYKPPARAMAPTPPARGCTSS
SCHEMBL28766687 0.81 SYK (0.48) SYKMAPTCTSSCTSLCTSB
SCHEMBL1054435 0.81 SYK (0.48) SYKMAPTCTSSCTSKCTSL
SCHEMBL11886701 0.81 SYK (0.54) SYKMAPTCTSSCTSKCTSL
SCHEMBL12205354 0.80 SYK (0.56) SYKPPARAMAPTPPARGCTSS

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-1797110-B1 ANTIBACTERIAL AMIDE MACROCYCLES IV AICURIS GMBH & CO KG (DE) 2011-01-12 EP 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-20070129288-A1 Antibacterial amide macrocycles BAYER HEALTHCARE AG (DE) 2007-06-07 US disclosed
EP-1515983-B1 ANTIBACTERIAL AMIDE MACROCYCLES AICURIS GMBH & CO KG (DE) 2007-02-21 EP disclosed
US-20060258571-A1 Antibacterial ester macrocycles AICURIS GMBH & CO. KG (DE) 2006-11-16 US disclosed
WO-2005118613-A2 ANTIBACTERIAL AMIDE MACROCYCLES AICURIS GMBH & CO.KG (DE) 2005-12-15 WO disclosed
US-20050256037-A1 Antibacterial amide macrocyles BAYER HEALTHCARE AG (DE) 2005-11-17 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 (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-20070129288-A1 Antibacterial amide macrocycles AADAC, AAAS, MRPL21 SYK 3831/4885PPARA 343/4885MAPT 3865/4885
US-20080076745-A1 ANTIBACTERIAL AMIDE MACROCYCLES IV NOD2, AAAS, AADAC SYK 3060/4885PPARA 169/4885MAPT 4356/4885
US-20050256037-A1 Antibacterial amide macrocyles AADAC, PAM, NOD2 SYK 3666/4885PPARA 80/4885MAPT 4168/4885
US-20060258571-A1 Antibacterial ester macrocycles TECR, MRPL21, CYP51A1 SYK 1443/4885PPARA 149/4885MAPT 4508/4885

“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.