SCHEMBL29954898

SCHEMBL29954898

CC(=O)Nc1ncccc1C=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 1/20 0.46
TRIM33 Q9UPN9 1/20 0.46
KMT2A Q03164 4/20 0.44
MEN1 O00255 2/20 0.44
S100A4 P26447 2/20 0.40
NPC1 O15118 4/20 0.40
RAB9A P51151 4/20 0.40
HTT P42858 1/20 0.40
ATM Q13315 1/20 0.40
PPIA P62937 1/20 0.39
L3MBTL1 Q9Y468 5/20 0.39
KDM4E B2RXH2 3/20 0.39
NPSR1 Q6W5P4 2/20 0.39
HSP90AA1 P07900 1/20 0.39
IDO1 P14902 1/20 0.39
CYP1A2 P05177 2/20 0.39
CYP2C9 P11712 2/20 0.39
CYP2C19 P33261 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TUBB4A P04350 1/20 0.38

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
SCHEMBL5044447 0.86 KMT2A (0.44) KMT2AMEN1S100A4NPC1RAB9A
SCHEMBL3713256 0.84 TRIM24 (0.47) TRIM24TRIM33KMT2AMEN1NPC1
SCHEMBL20805744 0.83 KMT2A (0.42) KMT2AMEN1S100A4NPC1RAB9A
SCHEMBL1375331 0.82 L3MBTL1 (0.45) TRIM24TRIM33KMT2AMEN1NPC1
SCHEMBL9000485 0.81 KMT2A (0.40) KMT2AMEN1S100A4NPC1RAB9A
SCHEMBL31048761 0.81 CA1 (0.44) KMT2AMEN1NPC1RAB9AHTT
SCHEMBL28110815 0.79 TRIM24 (0.42) TRIM24TRIM33KMT2AMEN1NPC1
SCHEMBL306384 0.79 METAP1 (0.44) TRIM24TRIM33RAB9AHTTL3MBTL1
SCHEMBL2211898 0.79 CYP1A2 (0.48) NPC1RAB9AHTTKDM4ECYP1A2
SCHEMBL31023942 0.78 TRIM24 (0.52) TRIM24TRIM33KMT2AMEN1NPC1

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-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed