SCHEMBL28409472

SCHEMBL28409472

O=C1CCCCCCC(=O)NN1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 4/20 0.50
FKBP5 Q13451 1/20 0.50
ALDH1A1 P00352 3/20 0.47
TRIM24 O15164 2/20 0.47
TRIM33 Q9UPN9 2/20 0.47
OR51E2 Q9H255 1/20 0.45
HPGD P15428 2/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 3/20 0.32
RAB9A P51151 2/20 0.31
MEN1 O00255 2/20 0.31
TSHR P16473 1/20 0.31
CYP2C19 P33261 1/20 0.31
MAPT P10636 3/20 0.31
ALOX15 P16050 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MAPK1 P28482 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
CA1 P00915 1/20 0.30
CA9 Q16790 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
SCHEMBL582193 1.00 CRBN (0.50) CRBNFKBP5ALDH1A1TRIM24TRIM33
SCHEMBL1395582 1.00 CRBN (0.50) CRBNFKBP5ALDH1A1TRIM24TRIM33
SCHEMBL141622 0.96 CRBN (0.53) CRBNFKBP5ALDH1A1TRIM24TRIM33
SCHEMBL5507318 0.89
SCHEMBL906641 0.81
SCHEMBL540663 0.80
SCHEMBL23028960 0.79 CRBN (0.80) CRBNFKBP5ALDH1A1TRIM24TRIM33
SCHEMBL5909153 0.79 CRBN (0.80) CRBNFKBP5ALDH1A1TRIM24TRIM33
SCHEMBL6049487 0.79 CRBN (0.80) CRBNFKBP5ALDH1A1TRIM24TRIM33
SCHEMBL8801853 0.79 CRBN (0.80) CRBNFKBP5ALDH1A1TRIM24TRIM33

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111269383-B Self-repairing polyurethane elastomer without external stimulation and preparation method thereof 青岛科技大学 2022-04-01 CN disclosed
CN-111269383-A Self-repairing polyurethane elastomer without external stimulation and preparation method thereof 青岛科技大学 2020-06-12 CN disclosed