SCHEMBL36610

SCHEMBL36610

NC(CCC(=O)NC(=O)OCc1ccccc1)C(=O)NCC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 1/20 0.47
SLC1A1 P43005 1/20 0.47
MME P08473 1/20 0.47
ECE1 P42892 1/20 0.47
LTA4H P09960 9/20 0.47
HTT P42858 1/20 0.46
ANPEP P15144 1/20 0.45
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
DPP8 Q6V1X1 1/20 0.42
DPP7 Q9UHL4 1/20 0.42

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
SCHEMBL5160238 1.00 SLC1A3 (0.47) SLC1A3SLC1A1MMEECE1LTA4H
SCHEMBL4541364 0.85 LTA4H (0.58) SLC1A3SLC1A1LTA4HHTT
SCHEMBL8761303 0.85 LTA4H (0.58) SLC1A3SLC1A1LTA4HHTT
SCHEMBL10421367 0.85 LTA4H (0.52) SLC1A3SLC1A1LTA4HHTTLMNA
SCHEMBL11153003 0.84 LTA4H (0.59) SLC1A3SLC1A1LTA4HHTTLMNA
SCHEMBL7303955 0.82 LTA4H (0.58) SLC1A3SLC1A1MMEECE1LTA4H
SCHEMBL14864739 0.81 CYP1A2 (0.50) SLC1A3SLC1A1LTA4H
SCHEMBL10284240 0.81 CYP1A2 (0.50) SLC1A3SLC1A1LTA4H
SCHEMBL7760121 0.80 LTA4H (0.56) SLC1A3SLC1A1LTA4HHTTLMNA
SCHEMBL24793050 0.80 ANPEP (0.62) SLC1A3SLC1A1HTTANPEPDPP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8846863-B2 Heat stable protein ingredients UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2014-09-30 US disclosed
US-20110268680-A1 HEAT STABLE PROTEIN INGREDIENTS UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2011-11-03 US disclosed
US-20110184147-A1 ENZYME SUBSTRATE FOR LABELING OF PROTEIN KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2011-07-28 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-20110184147-A1 ENZYME SUBSTRATE FOR LABELING OF PROTEIN ASNS, FARSA, DNPEP SLC1A3 847/4885SLC1A1 1342/4885MME 943/4885

“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.