SCHEMBL28877340

SCHEMBL28877340

C=C(C)C(=O)N(C)S(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.50
MAPT P10636 1/20 0.49
MCOLN3 Q8TDD5 1/20 0.49
C5AR1 P21730 1/20 0.46
AGER Q15109 1/20 0.46
LMNA P02545 3/20 0.46
HTT P42858 1/20 0.46
KDM4E B2RXH2 2/20 0.46
CA12 O43570 1/20 0.45
CA9 Q16790 1/20 0.45
TSHR P16473 1/20 0.44
KEAP1 Q14145 1/20 0.44
NFE2L2 Q16236 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.42
ATM Q13315 1/20 0.41
HSD11B1 P28845 1/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL28877338 0.84 HSD11B1 (0.59) ALDH1A1MAPTLMNAHTTKDM4E
SCHEMBL29065272 0.82 ALDH1A1 (0.55) ALDH1A1MAPTMCOLN3C5AR1AGER
SCHEMBL27177337 0.80 ALDH1A1 (0.57) ALDH1A1MAPTMCOLN3C5AR1AGER
SCHEMBL16004915 0.79 ALDH1A1 (0.50) ALDH1A1MAPTMCOLN3C5AR1AGER
SCHEMBL21113617 0.79 ALDH1A1 (0.47) ALDH1A1MAPTMCOLN3C5AR1AGER
SCHEMBL11326000 0.78 KEAP1 (0.57) ALDH1A1MAPTMCOLN3C5AR1AGER
SCHEMBL31220422 0.76 KMT2A (0.54) ALDH1A1MAPTC5AR1LMNAKDM4E
SCHEMBL17833663 0.76 CA12 (0.43) MAPTMCOLN3LMNAKDM4ECA12
SCHEMBL4847661 0.76 ALDH1A1 (0.50) ALDH1A1MAPTMCOLN3C5AR1AGER
SCHEMBL13038560 0.75 C5AR1 (0.52) MAPTMCOLN3C5AR1LMNAKDM4E

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-115260135-A Synthesis method of oxindole compound 浙江工业大学 2022-11-01 CN disclosed