SCHEMBL10520779

SCHEMBL10520779

C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ GHSR Q92847 3/20 0.54
▸ BACE1 P56817 8/20 0.51
▸ GNPAT O15228 1/20 0.50
▸ MMP2 P08253 1/20 0.47
▸ CTSD P07339 1/20 0.47

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
SCHEMBL30799499 0.96 GHSR (0.56) GHSRBACE1GNPATMMP2
SCHEMBL30628702 0.93 GHSR (0.56) GHSRGNPATMMP2
SCHEMBL29531757 0.93 GHSR (0.56) GHSRGNPATMMP2
SCHEMBL29720348 0.91 BACE1 (0.60) GHSRBACE1CTSD
SCHEMBL29575648 0.90 NAALAD2 (0.56) GHSRBACE1GNPATCTSD
SCHEMBL30579779 0.90 GNPAT (0.61) GHSRGNPATMMP2
SCHEMBL30974110 0.90 MME (0.55) BACE1MMP2
SCHEMBL31254405 0.89 GNPAT (0.62) GHSRGNPATMMP2
SCHEMBL1711453 0.89 GNPAT (0.62) GHSRGNPATMMP2
SCHEMBL1711458 0.89 GNPAT (0.62) GHSRGNPATMMP2

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
EP-0156540-B1 A GLUTAMATE RECEPTOR INHIBITOR Takeda Chemical Industries, Ltd. (JP) 1989-12-13 — — EP disclosed
US-4855405-A Glutamate receptor inhibitor TOKYO METROPOLITAN INSTITUTE FOR NEUROSCIENCES (JP) 1989-08-08 — — US disclosed
EP-0156540-A1 A glutamate receptor inhibitor Takeda Chemical Industries, Ltd. (JP) 1985-10-02 — — EP disclosed
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