SCHEMBL4856702

SCHEMBL4856702

CC(C)(C)OC(=O)NCCNC(=O)CC(CC(NC(=O)OCc1ccccc1)C(C)(C)C)NC(=O)O

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.55
MAPT P10636 2/20 0.45
IDO1 P14902 1/20 0.42
CTSK P43235 5/20 0.41
KLK7 P49862 2/20 0.41
KLK5 Q9Y337 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 1/20 0.41
RECQL P46063 1/20 0.41
KMT2A Q03164 1/20 0.41
CTSL P07711 1/20 0.40
CTSB P07858 1/20 0.40
CTSS P25774 1/20 0.40
PSMB5 P28074 1/20 0.40
POLB P06746 1/20 0.40
MAPK1 P28482 1/20 0.40
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CTRB1 P17538 2/20 0.39

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
SCHEMBL4850903 0.89 SYK (0.55) SYKMAPTKLK7KLK5L3MBTL1
SCHEMBL4883932 0.82 SYK (0.59) SYKMAPTIDO1KLK7KLK5
SCHEMBL2724477 0.79 SYK (0.72) SYKMAPTIDO1CTSKCTSL
SCHEMBL2724479 0.79 SYK (0.72) SYKMAPTIDO1CTSKCTSL
SCHEMBL18493490 0.79 SYK (0.72) SYKMAPTIDO1CTSKCTSL
SCHEMBL15202883 0.77 SYK (0.64) SYKMAPTIDO1KLK7KLK5
SCHEMBL4856698 0.77 SYK (0.55) SYKMAPTIDO1KLK7KLK5
SCHEMBL3913562 0.76 SYK (0.52) SYKCTSKCTSLCTSBCTSS
SCHEMBL30544325 0.76 SYK (0.57) SYKMAPTIDO1CTSKKLK7
SCHEMBL12798896 0.76 SYK (0.57) SYKMAPTCTSKCTSLCTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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-20080076745-A1 ANTIBACTERIAL AMIDE MACROCYCLES IV NOD2, AAAS, AADAC SYK 3060/4885MAPT 4356/4885IDO1 2481/4885

“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.