SCHEMBL10270725

SCHEMBL10270725

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

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.54
PPARA Q07869 3/20 0.48
ATM Q13315 1/20 0.48
CTSS P25774 4/20 0.46
ALDH1A1 P00352 2/20 0.46
MAPT P10636 1/20 0.46
KLK7 P49862 2/20 0.45
KLK5 Q9Y337 2/20 0.45
PPARG P37231 2/20 0.44
MEN1 O00255 1/20 0.44
HPGD P15428 1/20 0.44
KMT2A Q03164 1/20 0.44
CTSL P07711 2/20 0.43
CTSK P43235 3/20 0.43
ACE P12821 1/20 0.43
CTRB1 P17538 2/20 0.42
CTSB P07858 1/20 0.42
APP P05067 1/20 0.41

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
SCHEMBL3466396 0.87 SYK (0.57) SYKPPARAATMCTSSALDH1A1
SCHEMBL3466395 0.87 SYK (0.57) SYKPPARAATMCTSSALDH1A1
SCHEMBL24298360 0.87 SYK (0.57) SYKPPARAATMCTSSALDH1A1
SCHEMBL18575403 0.86 SYK (0.56) SYKPPARAATMCTSSALDH1A1
SCHEMBL25907995 0.86 SYK (0.56) SYKPPARAATMCTSSALDH1A1
SCHEMBL25318929 0.86 SYK (0.56) SYKPPARAATMCTSSALDH1A1
SCHEMBL17513638 0.86 SYK (0.56) SYKPPARAATMCTSSALDH1A1
SCHEMBL28986608 0.86 SYK (0.53) SYKPPARAATMCTSSALDH1A1
SCHEMBL28986607 0.86 SYK (0.53) SYKPPARAATMCTSSALDH1A1
SCHEMBL8607451 0.85 SYK (0.55) SYKPPARAATMCTSSALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8946224-B2 Substituted [1,2,4]triazolo[4,3-A]pyrazines for medicaments and pharmaceutical compositions REDX PHARMA LIMITED (GB) 2015-02-03 US disclosed
US-8946224-B2 Substituted [1,2,4]triazolo[4,3-A]pyrazines for medicaments and pharmaceutical compositions REDX PHARMA LIMITED (GB) 2015-02-03 US disclosed
US-20130225594-A1 DRUG DERIVATIVES REDX PHARMA PLC (GB) 2013-08-29 US disclosed
US-20130225594-A1 DRUG DERIVATIVES REDX PHARMA PLC (GB) 2013-08-29 US disclosed
WO-2012063085-A2 DRUG DERIVATIVES REDX PHARMA LIMITED (GB) 2012-05-18 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 (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-20130225594-A1 DRUG DERIVATIVES SQOR, NQO1, CYP2D6 SYK 1103/4885PPARA 1494/4885ATM 4457/4885

“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.