SCHEMBL7262078

SCHEMBL7262078

CCCCC(N)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC6A5 Q9Y345 1/20 0.49
▸ FOLH1 Q04609 1/20 0.46
▸ GSR P00390 1/20 0.46
▸ DPP8 Q6V1X1 2/20 0.44
▸ DPP9 Q86TI2 2/20 0.44
▸ DPP7 Q9UHL4 2/20 0.44
▸ GNAI3 P08754 1/20 0.44
▸ GNAO1 P09471 1/20 0.44
▸ GNAI1 P63096 1/20 0.44
▸ SIRT6 Q8N6T7 1/20 0.43
▸ SIRT1 Q96EB6 1/20 0.43
▸ TLR2 O60603 1/20 0.42
▸ RNPEP Q9H4A4 1/20 0.41
▸ NOD1 Q9Y239 3/20 0.40
▸ SLC1A2 P43004 2/20 0.40
▸ SLC1A1 P43005 2/20 0.40
▸ SLC1A3 P43003 1/20 0.40
▸ DPP4 P27487 1/20 0.39
▸ GRIK1 P39086 2/20 0.39
▸ GRIK2 Q13002 2/20 0.39

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
SCHEMBL6152930 0.90 GSR (0.52) SLC6A5FOLH1GSRRNPEPMMP2
SCHEMBL264838 0.90 NOD1 (0.48) SLC6A5NOD1SLC1A2SLC1A1GRIK1
SCHEMBL16295148 0.84 GSR (0.65) FOLH1GSRRNPEPNOD1MMP2
SCHEMBL30901213 0.83 SLC6A5 (0.54) SLC6A5FOLH1GSRDPP8DPP9
SCHEMBL28741345 0.83 FOLH1 (0.51) SLC6A5FOLH1GSRDPP8DPP9
SCHEMBL29529476 0.83 SLC6A5 (0.54) SLC6A5FOLH1GSRDPP8DPP9
SCHEMBL24376227 0.81 SLC6A5 (0.52) SLC6A5FOLH1GSRGNAI3GNAO1
SCHEMBL29463403 0.80 FOLH1 (0.49) SLC6A5FOLH1GSRGNAI3GNAO1
SCHEMBL4951252 0.80 GSR (0.52) SLC6A5FOLH1GSRRNPEPMMP2
SCHEMBL3389707 0.79 SLC6A5 (0.54) SLC6A5FOLH1GNAI3GNAO1GNAI1

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-6656687-B1 Peptide nucleic acid (PNA); in-situ hybridization (ISH); probes for detection of bacteria or eucarya in food, beverage, water, pharmaceutical/personal care/dairy products BOSTON PROBES, INC. 2003-12-02 — — US disclosed
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