SCHEMBL29954331

SCHEMBL29954331

CN(C)c1ncccc1C=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 2/20 0.52
TRIM33 Q9UPN9 2/20 0.52
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
LMNA P02545 1/20 0.41
THRB P10828 1/20 0.41
BLM P54132 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ALDH1A1 P00352 5/20 0.40
KDM4E B2RXH2 3/20 0.40
GAA P10253 1/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
HSP90AA1 P07900 1/20 0.40
IDO1 P14902 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
TSHR P16473 1/20 0.39
POLB P06746 1/20 0.37
AGTR1 P30556 1/20 0.36

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
SCHEMBL12253115 1.00 TRIM24 (0.52) TRIM24TRIM33KMT2AMEN1LMNA
SCHEMBL16570096 0.80 TRIM24 (0.44) TRIM24TRIM33KMT2AMEN1KDM4E
SCHEMBL20153719 0.80 KDM4E (0.37) TRIM24TRIM33LMNAALDH1A1KDM4E
SCHEMBL18726709 0.80 KDM4E (0.37) TRIM24TRIM33LMNAALDH1A1KDM4E
SCHEMBL2062668 0.77 KCNA5 (0.51) TRIM24TRIM33KMT2AMEN1ERN1
SCHEMBL9000291 0.76 KDM4E (0.38) TRIM24TRIM33LMNAALDH1A1KDM4E
SCHEMBL6493230 0.74 GRM5 (0.50) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL2215225 0.74 TRIM24 (0.42) TRIM24TRIM33KMT2AMEN1LMNA
SCHEMBL20797705 0.74 TRIM24 (0.42) TRIM24TRIM33KMT2AMEN1LMNA
SCHEMBL832535 0.74 TRIM24 (0.42) TRIM24TRIM33KMT2AMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4333819-A1 TREATMENT OF PHARMACORESISTANT EPILEPSY Katholieke Universiteit Leuven (BE) 2024-03-13 EP disclosed
WO-2022233877-A1 TREATMENT OF PHARMACORESISTANT EPILEPSY KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2022-11-10 WO disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed