SCHEMBL28877353

SCHEMBL28877353

C=C(C)C(=O)N(CC)S(=O)(=O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.46
HSD11B1 P28845 3/20 0.45
TDP1 Q9NUW8 1/20 0.42
CNR2 P34972 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ESR1 P03372 1/20 0.42
NR1I2 O75469 1/20 0.41
MAPT P10636 1/20 0.40
ALDH1A1 P00352 1/20 0.40
PSIP1 O75475 1/20 0.40
TAS2R14 Q9NYV8 1/20 0.40
LMNA P02545 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL31220506 0.84 HSD11B1 (0.61) KMT2AHSD11B1CNR2MAPTTAS2R14
SCHEMBL25736043 0.83 KMT2A (0.56) KMT2AHSD11B1TDP1CNR2L3MBTL1
SCHEMBL28877338 0.78 HSD11B1 (0.59) KMT2AHSD11B1NR1I2MAPTALDH1A1
SCHEMBL30038589 0.78 HSD11B1 (0.49) KMT2AHSD11B1TDP1CNR2L3MBTL1
SCHEMBL29150781 0.75 KMT2A (0.65) KMT2AHSD11B1TDP1ESR1MAPT
SCHEMBL11566554 0.74 HSD11B1 (0.45) KMT2AHSD11B1TDP1CNR2L3MBTL1
SCHEMBL30309104 0.74 POLB (0.47) KMT2AHSD11B1TDP1CNR2L3MBTL1
SCHEMBL17833663 0.74 CA12 (0.43) KMT2ACNR2MAPTTAS2R14LMNA
SCHEMBL31220539 0.73 HSD11B1 (0.44) KMT2AHSD11B1CNR2MAPTALDH1A1
SCHEMBL3899893 0.73 KMT2A (0.56) KMT2AHSD11B1MAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115260135-B Synthesis method of oxindole compound 浙江工业大学 2024-02-13 CN disclosed
CN-115260135-A Synthesis method of oxindole compound 浙江工业大学 2022-11-01 CN disclosed