SCHEMBL27408566

SCHEMBL27408566

CCCCOC(=O)C(N)CC(=O)OC(=O)C(N)C(C)CC

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ NAAA Q02083 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.36
▸ NOD1 Q9Y239 3/20 0.35
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ MAPT P10636 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ ATM Q13315 1/20 0.34
▸ NPC1 O15118 2/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ HPGD P15428 2/20 0.33
▸ IARS1 P41252 5/20 0.33
▸ TSHR P16473 1/20 0.33
▸ DPP4 P27487 1/20 0.32
▸ DPP8 Q6V1X1 1/20 0.32
▸ DPP9 Q86TI2 1/20 0.32

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
SCHEMBL10363590 0.83 ALDH1A1 (0.47) NAAAALDH1A1L3MBTL1MAPTNPSR1
SCHEMBL14514324 0.83 NAAA (0.47) NAAAALDH1A1NOD1L3MBTL1MAPT
SCHEMBL1396441 0.83 NAAA (0.47) NAAAALDH1A1NOD1L3MBTL1MAPT
SCHEMBL7366588 0.83 ALDH1A1 (0.47) NAAAALDH1A1L3MBTL1MAPTNPSR1
SCHEMBL8407943 0.83 NAAA (0.47) NAAAALDH1A1NOD1L3MBTL1MAPT
Hydrochloric Acid SCHEMBL3914765 0.81 NPSR1 (0.48) NAAAALDH1A1NOD1L3MBTL1MAPT
Hydrochloric Acid SCHEMBL3914767 0.81 NPSR1 (0.48) NAAAALDH1A1NOD1L3MBTL1MAPT
SCHEMBL5165368 0.80 GRIK1 (0.42) DPP4DPP8DPP9
SCHEMBL1644712 0.78 NAAA (0.55) NAAANOD1L3MBTL1MAPTMAPK1
SCHEMBL20511639 0.78 NAAA (0.46) NAAAALDH1A1NOD1L3MBTL1MAPT

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
CN-1030766-A This fourth of anka: a class has their preparation method of new glycopeptide that suppresses the enkephalinase effect and as the application of medicine HOECHST AG (DE) 1989-02-01 — — CN disclosed
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