SCHEMBL28257941

SCHEMBL28257941

[CH2]c1cccc(S(=O)(=O)CCC(C)(C)C)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.38
KMT2A Q03164 4/20 0.33
MEN1 O00255 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
LMNA P02545 2/20 0.33
HSD11B1 P28845 2/20 0.33
PSIP1 O75475 1/20 0.33
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
ALDH1A1 P00352 6/20 0.32
NPSR1 Q6W5P4 2/20 0.32
POLB P06746 1/20 0.32
NR1H2 P55055 1/20 0.31
NR1H3 Q13133 1/20 0.31
HTT P42858 2/20 0.31
CYP3A4 P08684 3/20 0.31
CYP2C19 P33261 3/20 0.31

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
SCHEMBL2451016 0.78 PSIP1 (0.56) CA2KMT2AMEN1HSD11B1PSIP1
SCHEMBL2536096 0.78 PSIP1 (0.56) CA2KMT2ASMN1; SMN2HSD11B1PSIP1
SCHEMBL28077902 0.73 TP53 (0.44) CA2KMT2AMEN1SMN1; SMN2LMNA
SCHEMBL27829 0.70 SMN1; SMN2 (0.40) CA2SMN1; SMN2ALDH1A1CA1
SCHEMBL17803840 0.69 ALDH1A1 (0.64) CA2KMT2AMEN1SMN1; SMN2LMNA
SCHEMBL1908884 0.68 PSIP1 (0.52) CA2KMT2AMEN1HSD11B1PSIP1
SCHEMBL15577883 0.68 PLCG1 (0.55) CA2KMT2AMEN1LMNAHSD11B1
SCHEMBL2535633 0.68 CRBN (0.41) SMN1; SMN2PSIP1MAPTALDH1A1
SCHEMBL1271000 0.68 CA2 (0.54) CA2KMT2AMEN1HSD11B1ALDH1A1
SCHEMBL13650701 0.67 CA2 (0.49) CA2KMT2AMEN1LMNAHSD11B1

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-108864076-A glucosylceramide synthase inhibitors 建新公司 2018-11-23 CN disclosed