SCHEMBL27368035

SCHEMBL27368035

CCCCCOC(O)CC(O)OCC

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
USP2 O75604 1/20 0.38
HTT P42858 2/20 0.37
LPAR1 Q92633 4/20 0.35
LPAR3 Q9UBY5 4/20 0.35
LPAR2 Q9HBW0 1/20 0.35
MEN1 O00255 1/20 0.34
THRB P10828 1/20 0.34
KMT2A Q03164 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
MAPT P10636 1/20 0.34
SPHK1 Q9NYA1 1/20 0.34

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
SCHEMBL497155 0.83 DNM1 (0.41) DNM1ALDH1A1CNR1CNR2USP2
SCHEMBL11775904 0.81 THRB (0.44) THRB
SCHEMBL1095934 0.79 DNM1 (0.45) DNM1ALDH1A1CNR1CNR2USP2
SCHEMBL8093873 0.77 DNM1 (0.43) DNM1ALDH1A1CNR1CNR2USP2
SCHEMBL4582497 0.77 DNM1 (0.48) DNM1USP2HTTLPAR1LPAR3
SCHEMBL23038764 0.77 DNM1 (0.43) DNM1ALDH1A1CNR1CNR2USP2
SCHEMBL4635532 0.77 DNM1 (0.48) DNM1USP2HTTLPAR1LPAR3
SCHEMBL1978801 0.77 DNM1 (0.48) DNM1USP2HTTLPAR1LPAR3
SCHEMBL23038765 0.77 DNM1 (0.48) DNM1USP2HTTLPAR1LPAR3
SCHEMBL6021620 0.77 DNM1 (0.48) DNM1USP2HTTLPAR1LPAR3

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
WO-2023239836-A9 LIPIDS, NANOPARTICLES COMPRISING THE SAME AND USES THEREOF ACADEMIA SINICA (TW) 2024-02-01 WO disclosed