SCHEMBL17718266

SCHEMBL17718266

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

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GRIK1 P39086 3/20 0.34
▸ GRIK2 Q13002 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ PTGS1 P23219 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
SCHEMBL26754222 0.81 GRIK1 (0.34) GRIK1GRIK2ALDH1A1MAPTPTGS1
SCHEMBL13898634 0.81 GRIK1 (0.52) GRIK1GRIK2PTGS1SLC7A5
SCHEMBL17718260 0.81 GRIK1 (0.52) GRIK1GRIK2PTGS1SLC7A5
SCHEMBL16017804 0.81 GRIK1 (0.52) GRIK1GRIK2PTGS1SLC7A5
SCHEMBL16017787 0.77 GRIK1 (0.32) GRIK1SLC7A5
SCHEMBL16185835 0.77 GRIK1 (0.37) GRIK1GRIK2
SCHEMBL16841491 0.77 GRIK1 (0.37) GRIK1GRIK2
SCHEMBL20830102 0.75 GABRP (0.37) GRIK1ALDH1A1MAPTPTGS1SLC7A5
SCHEMBL13019133 0.74 — —
SCHEMBL14117404 0.74 — —

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-9737523-B2 Anti-fibrogenic compounds, methods and uses thereof THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2017-08-22 — — US disclosed
US-20160120857-A1 Anti-Fibrogenic Compounds, Methods and Uses Thereof THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2016-05-05 — — 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-20160120857-A1 Anti-Fibrogenic Compounds, Methods and Uses Thereof KYNU, AADAT, KMO GRIK1 309/4885GRIK2 396/4885ALDH1A1 1221/4885

“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.

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