SCHEMBL2610090

SCHEMBL2610090

CC(=O)C(N)CC(=O)ON

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.34
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
GRIK2 Q13002 1/20 0.30
SLC7A5 Q01650 1/20 0.30

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
SCHEMBL5674932 0.81 MGAM (0.44) GRIK1MGAMGAASIMGAM2
SCHEMBL10005848 0.81 MGAM (0.44) GRIK1MGAMGAASIMGAM2
Hydrochloric Acid SCHEMBL8106859 0.79 MGAM (0.42) GRIK1MGAMGAASIMGAM2
SCHEMBL28296858 0.78 TSHR (0.31)
SCHEMBL14388352 0.78 GRIK1 (0.48) GRIK1GRIK2SLC7A5
SCHEMBL291079 0.78
SCHEMBL14882533 0.78 GRIK1 (0.48) GRIK1GRIK2SLC7A5
SCHEMBL1078699 0.78
SCHEMBL2610089 0.77 SLC1A1 (0.38) GRIK1MGAMGAASIMGAM2
SCHEMBL12754580 0.76 ALDH1A1 (0.35) MGAMGAASIMGAM2

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-20120101163-A1 COMPOSITION FOR INHIBITING CANCER METASTASIS TAIPEI MEDICAL UNIVERSITY (TW) 2012-04-26 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-20120101163-A1 COMPOSITION FOR INHIBITING CANCER METASTASIS HDGF, MIF, HGF GRIK1 1209/4885MGAM 3918/4885GAA 3866/4885

“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.