SCHEMBL11325779

SCHEMBL11325779

CCCCC(C=CCC(N)=O)C(N)=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.46
CA1 P00915 2/20 0.46
FAAH O00519 3/20 0.39
SOAT1 P35610 2/20 0.39
MEN1 O00255 1/20 0.39
TP53 P04637 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C19 P33261 1/20 0.39
KMT2A Q03164 1/20 0.39
CNR1 P21554 1/20 0.37
KDM4E B2RXH2 2/20 0.36
ACHE P22303 1/20 0.35
BACE1 P56817 1/20 0.35
MAPK1 P28482 1/20 0.34
SLC1A3 P43003 1/20 0.33
SLC1A2 P43004 1/20 0.33
SLC1A1 P43005 1/20 0.33
EPHX1 P07099 1/20 0.33
DPP7 Q9UHL4 1/20 0.33

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
SCHEMBL11321236 0.93 FAAH (0.44) CA2CA1FAAHSOAT1MEN1
SCHEMBL11331229 0.93 FAAH (0.44) CA2CA1FAAHSOAT1MEN1
SCHEMBL30701385 0.79 FAAH (0.44) FAAHSOAT1MEN1TP53CYP1A2
SCHEMBL3374129 0.79 MEN1 (0.53) FAAHSOAT1MEN1TP53CYP1A2
SCHEMBL3375002 0.79 MEN1 (0.53) FAAHSOAT1MEN1TP53CYP1A2
SCHEMBL3375007 0.79 MEN1 (0.53) FAAHSOAT1MEN1TP53CYP1A2
SCHEMBL3374134 0.79 MEN1 (0.53) FAAHSOAT1MEN1TP53CYP1A2
SCHEMBL30701336 0.79 FAAH (0.44) FAAHSOAT1MEN1TP53CYP1A2
SCHEMBL8014889 0.76 CA2 (0.52) CA2CA1MAPK1SLC1A3SLC1A2
SCHEMBL16754663 0.75 CA2 (0.43) CA2CA1ACHEBACE1MAPK1

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-4292151-A MELT SPINNING THE BLOCK POLYMER WITH AN UNSATURATED COMPOUND; CURING WITH ACTINIC RADIATION TEIJIN LIMITED (JP) 1981-09-29 US disclosed