SCHEMBL18098558

SCHEMBL18098558

CC(=O)C(N)CC(=O)[C@H](C)C(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SLC1A3 P43003 1/20 0.32
▸ SLC1A2 P43004 1/20 0.32
▸ SLC1A1 P43005 1/20 0.32
▸ GRIK1 P39086 2/20 0.32
▸ DPP4 P27487 1/20 0.32
▸ SLC7A5 Q01650 2/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL21309249 0.80 GABRP (0.34) SLC1A3SLC1A2SLC1A1GRIK1DPP4
SCHEMBL12368601 0.78 ALDH1A1 (0.36) SLC1A3SLC1A2SLC1A1GRIK1SLC7A5
SCHEMBL25712091 0.78 ALDH1A1 (0.36) SLC1A3SLC1A2SLC1A1GRIK1SLC7A5
SCHEMBL17718266 0.71 GRIK1 (0.34) GRIK1SLC7A5ALDH1A1
SCHEMBL13019133 0.69 — —
SCHEMBL14117404 0.69 — —
SCHEMBL12249985 0.69 — —
SCHEMBL12336186 0.69 — —
SCHEMBL7587650 0.69 — —
SCHEMBL13039773 0.69 — —

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
EP-3072506-A1 CARRIER FOR DRUG DELIVERY AND CONJUGATE, COMPOSITION CONTAINING SAME, AND METHOD FOR ADMINISTERING SAME The University of Tokyo (JP) 2016-09-28 — — EP disclosed
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