SCHEMBL20081691

SCHEMBL20081691

CCCC(=O)CCCN1C(=N)N(C)CC1=O

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.35
▸ MAPT P10636 2/20 0.32
▸ MAPK1 P28482 2/20 0.32
▸ RECQL P46063 1/20 0.32
▸ HDAC6 Q9UBN7 1/20 0.30

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
SCHEMBL3428460 0.83 PTGS1 (0.41) KDM4EMAPK1
SCHEMBL5035064 0.83 HDAC6 (0.32) KDM4EMAPTRECQLHDAC6
SCHEMBL3425627 0.83 PAOX (0.34) KDM4EMAPTRECQLHDAC6
SCHEMBL19675040 0.81 HDAC6 (0.31) KDM4EMAPTRECQLHDAC6
SCHEMBL31188474 0.79 KDM4E (0.42) KDM4EMAPTMAPK1RECQL
SCHEMBL3425614 0.79 MEN1 (0.32) HDAC6
Bromide SCHEMBL5041514 0.78 FKBP1A (0.41) KDM4EMAPTMAPK1RECQL
SCHEMBL8535515 0.78 PLA2G7 (0.33) HDAC6
SCHEMBL19229985 0.78 PLA2G7 (0.31) —
Iodide SCHEMBL8540820 0.77 PLA2G7 (0.33) HDAC6

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-3312640-A1 METHODS FOR AMPLIFYING AND DETECTING PATHOGEN NUCLEIC ACID IN A WHOLE BLOOD SAMPLE T2 Biosystems, Inc. (US) 2018-04-25 — — EP disclosed
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