SCHEMBL15545289

SCHEMBL15545289

NCCOCCOCCOCCOC12CC3CC(CC(C3)C1)C2.OCCOCCOCCOCCOC12CC3CC(CC(C3)C1)C2

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
ALDH1A1 P00352 4/20 0.33
GRIN2D O15399 4/20 0.33
GRIN3B O60391 4/20 0.33
GRIN1 Q05586 4/20 0.33
GRIN2A Q12879 4/20 0.33
GRIN2B Q13224 4/20 0.33
GRIN2C Q14957 4/20 0.33
GRIN3A Q8TCU5 4/20 0.33
NPSR1 Q6W5P4 2/20 0.33
HTT P42858 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
LMNA P02545 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL16683781 0.91 MEN1 (0.44) MEN1KMT2AALDH1A1NPSR1HTT
SCHEMBL15532888 0.91 MEN1 (0.44) MEN1KMT2AALDH1A1NPSR1HTT
SCHEMBL15533296 0.91 GRIN2D (0.39) MEN1KMT2AALDH1A1GRIN2DGRIN3B
SCHEMBL21997787 0.91 MEN1 (0.44) MEN1KMT2AALDH1A1NPSR1HTT
SCHEMBL15532601 0.91 GRIN2D (0.39) MEN1KMT2AALDH1A1GRIN2DGRIN3B
SCHEMBL15532220 0.91 GRIN2D (0.39) MEN1KMT2AALDH1A1GRIN2DGRIN3B
SCHEMBL12687856 0.91 MEN1 (0.44) MEN1KMT2AALDH1A1NPSR1HTT
SCHEMBL15532934 0.91 MEN1 (0.44) MEN1KMT2AALDH1A1NPSR1HTT
SCHEMBL4389248 0.80 ALDH1A1 (0.41) MEN1KMT2AALDH1A1GRIN2DGRIN3B
SCHEMBL5933135 0.80 GRIN2D (0.44) MEN1KMT2AALDH1A1GRIN2DGRIN3B

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
EP-2846784-A1 COMPOUNDS USEFUL FOR PROMOTING PROTEIN DEGRADATION AND METHODS USING SAME Yale University (US) 2015-03-18 EP disclosed
WO-2013170147-A1 COMPOUNDS USEFUL FOR PROMOTING PROTEIN DEGRADATION AND METHODS USING SAME YALE UNIVERSITY (US) 2013-11-14 WO disclosed