SCHEMBL23937112

SCHEMBL23937112

COC(=O)CCC(C)CC(C)CN(C)C

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
SLC1A1 P43005 1/20 0.40
GAA P10253 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
CA12 O43570 2/20 0.33
CA14 Q9ULX7 2/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
LMNA P02545 2/20 0.32
KDM4E B2RXH2 1/20 0.32
HSD17B10 Q99714 2/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
MGAM O43451 1/20 0.30
SI P14410 1/20 0.30
MGAM2 Q2M2H8 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
SCHEMBL14865411 0.79 TSHR (0.50) TSHRKMT2AMEN1SLC1A1GAA
SCHEMBL27904910 0.79 BLM (0.47) TSHRKMT2AMEN1SLC1A1L3MBTL1
SCHEMBL27350543 0.78 MEN1 (0.38) TSHRKMT2AMEN1SLC1A1GAA
SCHEMBL21164254 0.76 SLC1A1 (0.45) TSHRKMT2AMEN1SLC1A1CA12
SCHEMBL23771193 0.75 GAA (0.41) TSHRKMT2AMEN1GAAL3MBTL1
SCHEMBL125808 0.74
SCHEMBL3685300 0.72 TSHR (0.52) TSHRKMT2AMEN1SLC1A1GAA
SCHEMBL12951352 0.72 TSHR (0.52) TSHRKMT2AMEN1SLC1A1GAA
SCHEMBL3584800 0.72 TSHR (0.52) TSHRKMT2AMEN1SLC1A1GAA
SCHEMBL3309517 0.72 TSHR (0.52) TSHRKMT2AMEN1SLC1A1GAA

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
EP-3473611-B1 TRIALKYL CATIONIC LIPIDS AND METHODS OF USE THEREOF ARBUTUS BIOPHARMA CORP (CA) 2021-10-20 EP disclosed