SCHEMBL28625151

SCHEMBL28625151

CCCCCCNC(=O)C1CCCN1C(=O)OC(C)(C)C

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.61
MEN1 O00255 2/20 0.61
SMN1; SMN2 Q16637 1/20 0.58
PRCP P42785 1/20 0.56
HDAC8 Q9BY41 4/20 0.55
NPSR1 Q6W5P4 2/20 0.54
ALDH1A1 P00352 1/20 0.53
POLB P06746 2/20 0.52
NAAA Q02083 1/20 0.50
NPC1 O15118 1/20 0.50
LMNA P02545 1/20 0.48
SCN5A Q14524 1/20 0.48
SCN3A Q9NY46 1/20 0.48
TSHR P16473 1/20 0.47
HSD17B10 Q99714 1/20 0.47

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
SCHEMBL28642107 1.00 KMT2A (0.61) KMT2AMEN1SMN1; SMN2PRCPHDAC8
SCHEMBL28626823 1.00 KMT2A (0.61) KMT2AMEN1SMN1; SMN2PRCPHDAC8
SCHEMBL5898621 1.00 KMT2A (0.61) KMT2AMEN1SMN1; SMN2PRCPHDAC8
SCHEMBL28627160 1.00 KMT2A (0.61) KMT2AMEN1SMN1; SMN2PRCPHDAC8
SCHEMBL28622823 1.00 KMT2A (0.61) KMT2AMEN1SMN1; SMN2PRCPHDAC8
SCHEMBL28631573 1.00 KMT2A (0.61) KMT2AMEN1SMN1; SMN2PRCPHDAC8
SCHEMBL5898624 0.96 KMT2A (0.57) KMT2AMEN1SMN1; SMN2PRCPHDAC8
SCHEMBL5898611 0.95 KMT2A (0.56) KMT2AMEN1SMN1; SMN2PRCPHDAC8
SCHEMBL28629956 0.95 KMT2A (0.66) KMT2AMEN1SMN1; SMN2PRCPHDAC8
SCHEMBL6242176 0.95 KMT2A (0.66) KMT2AMEN1SMN1; SMN2PRCPHDAC8

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
CN-109641878-B DIPROVOCIM: effective TLR agonist 斯克里普斯研究学院 2021-09-14 CN disclosed