SCHEMBL10909146

SCHEMBL10909146

CC(C)CC(C(=O)O)N(C(=O)OCc1ccccc1)C(=O)C(N)CO.c1ccc2c(c1)C2

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 5/20 0.40
▸ CTSB P07858 3/20 0.40
▸ CTSL P07711 2/20 0.40
▸ CTSS P25774 2/20 0.40
▸ SLC1A1 P43005 3/20 0.38
▸ SLC1A3 P43003 2/20 0.38
▸ ANPEP P15144 1/20 0.36
▸ RNPEP Q9H4A4 1/20 0.36
▸ DNPEP Q9ULA0 1/20 0.36
▸ SLC15A1 P46059 1/20 0.36
▸ SLC1A2 P43004 1/20 0.35
▸ CAPN1 P07384 1/20 0.35

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
SCHEMBL11433447 0.94 SLC1A1 (0.41) CTSKCTSBCTSLCTSSSLC1A1
SCHEMBL10443784 0.85 SLC15A1 (0.46) CTSKCTSBCTSLCTSSSLC1A1
SCHEMBL999188 0.81 CTSK (0.47) CTSKCTSBCTSLCTSS
SCHEMBL27809385 0.81 ANPEP (0.48) CTSKCTSBCTSLCTSSSLC1A1
SCHEMBL15558106 0.78 LAP3 (0.48) CTSKCTSBCTSLCTSSANPEP
SCHEMBL27715040 0.78 ANPEP (0.40) CTSKCTSBCTSLCTSSSLC1A1
SCHEMBL18174177 0.78 ALDH1A1 (0.47) CTSKCTSBCTSLCTSSCAPN1
SCHEMBL30254757 0.77 SLC15A1 (0.40) CTSKCTSBCTSLCTSSSLC1A1
SCHEMBL8744670 0.77 SLC1A3 (0.41) CTSKCTSBCTSLCTSSSLC1A1
SCHEMBL10537523 0.77 CTSK (0.44) CTSKCTSBCTSLCTSSSLC15A1

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-4564471-A N-/BENZYLOXYCARBONYL/ASPARTYLPHENYLALANINE AJINOMOTO CO., INC. (JP) 1986-01-14 — — US disclosed
EP-0027319-B1 METHOD FOR REDUCTIVE ELIMINATION OF PROTECTING GROUPS AND PREPARATIVE PROCESS USING SUCH METHOD AJINOMOTO CO., INC. (JP) 1982-08-11 — — EP disclosed
EP-0027319-A2 Method for reductive elimination of protecting groups and preparative process using such method AJINOMOTO CO., INC. (JP) 1981-04-22 — — EP disclosed
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