SCHEMBL19166196

SCHEMBL19166196

CC(C)CC(N)C(=O)OCCCCCCCCOC(=O)C(N)CC(C)C

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.50
SLC1A3 P43003 1/20 0.39
SLC1A2 P43004 1/20 0.39
ANPEP P15144 5/20 0.38
RNPEP Q9H4A4 2/20 0.38
DNPEP Q9ULA0 1/20 0.38
NOD1 Q9Y239 2/20 0.38
NAAA Q02083 1/20 0.36
LAP3 P28838 2/20 0.34
ALDH1A1 P00352 2/20 0.34
TSHR P16473 2/20 0.34
CYP3A4 P08684 1/20 0.34
ERAP1 Q9NZ08 1/20 0.34
EPHX1 P07099 1/20 0.34
FAAH O00519 1/20 0.34
DPP4 P27487 1/20 0.34
MAPK1 P28482 1/20 0.33
FLT3 P36888 1/20 0.33
GSK3B P49841 1/20 0.33

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
SCHEMBL12551467 1.00 SLC7A5 (0.50) SLC7A5SLC1A3SLC1A2ANPEPRNPEP
SCHEMBL18347411 1.00 SLC7A5 (0.50) SLC7A5SLC1A3SLC1A2ANPEPRNPEP
SCHEMBL7647620 0.98 SLC7A5 (0.52) SLC7A5SLC1A3SLC1A2ANPEPRNPEP
SCHEMBL14095412 0.94 SLC7A5 (0.52) SLC7A5SLC1A3SLC1A2ANPEPRNPEP
SCHEMBL1479595 0.93 NAAA (0.48) SLC7A5NOD1NAAAALDH1A1TSHR
SCHEMBL7775081 0.93 NAAA (0.48) SLC7A5NOD1NAAAALDH1A1TSHR
SCHEMBL7775084 0.93 NAAA (0.48) SLC7A5NOD1NAAAALDH1A1TSHR
SCHEMBL1479492 0.93 NAAA (0.48) SLC7A5NOD1NAAAALDH1A1TSHR
SCHEMBL10824102 0.93 NAAA (0.48) SLC7A5NOD1NAAAALDH1A1TSHR
SCHEMBL16007698 0.93 NAAA (0.48) SLC7A5NOD1NAAAALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170210852-A1 DEGRADABLE AMINO ACID-BASED POLY (ESTER UREA) COPOLYMER ADHESIVES THE UNIVERSITY OF AKRON (US) 2017-07-27 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-20170210852-A1 DEGRADABLE AMINO ACID-BASED POLY (ESTER UREA) COPOLYMER ADHESIVES PNMT, UBE3A, PCNA SLC7A5 223/4885SLC1A3 60/4885SLC1A2 58/4885

“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.