SCHEMBL13311348

SCHEMBL13311348

C[C@H](NC(=O)OC(C)(C)C)C(=O)O[C@@H](C)C(=O)O[C@@H](C)C(=O)O[C@@H](C)C(=O)OCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.52
POLB P06746 1/20 0.50
PPARA Q07869 2/20 0.49
ATM Q13315 1/20 0.49
NTSR1 P30989 1/20 0.48
CTSL P07711 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
CTSS P25774 2/20 0.47
MAPT P10636 2/20 0.46
MAPK1 P28482 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
CTSK P43235 1/20 0.46
PPARG P37231 1/20 0.45

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
SCHEMBL1463134 0.90 POLB (0.58) SYKPOLBPPARAATMNTSR1
SCHEMBL648574 0.90 POLB (0.58) SYKPOLBPPARAATMNTSR1
SCHEMBL7512116 0.90 POLB (0.58) SYKPOLBPPARAATMNTSR1
SCHEMBL19820403 0.87 KLK5 (0.53) SYKPPARAATMCTSLCTSS
SCHEMBL13046582 0.87 KLK5 (0.53) SYKPPARAATMCTSLCTSS
SCHEMBL22791589 0.86 CTSS (0.57) SYKPOLBPPARAATMCTSL
SCHEMBL31027104 0.85 SYK (0.57) SYKPOLBPPARAATMNTSR1
SCHEMBL10604129 0.85 SYK (0.57) SYKPOLBPPARAATMNTSR1
SCHEMBL25054282 0.84 CTSK (0.58) SYKPPARAATMCTSLCTSS
SCHEMBL20043006 0.84 POLB (0.45) SYKPOLBATMCTSLL3MBTL1

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-8513188-B2 Formulations comprising cyclic compounds CAPSUGEL BELGIUM (BE) 2013-08-20 US disclosed
US-20100137188-A1 FORMULATIONS COMPRISING CYCLIC COMPOUNDS CAPSUGEL BELGIUM (BE) 2010-06-03 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-20100137188-A1 FORMULATIONS COMPRISING CYCLIC COMPOUNDS SLC2A1, SLC2A4, SLC2A9 SYK 1629/4885POLB 3155/4885PPARA 3811/4885

“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.