SCHEMBL8997495

SCHEMBL8997495

COC(=O)CN(c1ccc(Cl)cc1C(=O)C1CCCCC1)S(=O)(=O)c1ccc(OC)cc1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MCOLN3 Q8TDD5 1/20 0.53
PKM P14618 1/20 0.52
CAMK2A Q9UQM7 3/20 0.46
CAMK2G Q13555 1/20 0.46
KEAP1 Q14145 9/20 0.46
NFE2L2 Q16236 9/20 0.46
MAPT P10636 2/20 0.45
TP53 P04637 1/20 0.45
ALDH1A1 P00352 1/20 0.44
MMP3 P08254 1/20 0.43

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
SCHEMBL8989960 0.79 PSEN1 (0.50) MCOLN3KEAP1NFE2L2MAPTTP53
SCHEMBL8989872 0.79 MCOLN3 (0.47) MCOLN3
SCHEMBL8989882 0.76 NPSR1 (0.47) MCOLN3MAPTTP53ALDH1A1
SCHEMBL8989962 0.73 PKM (0.58) MCOLN3PKMKEAP1NFE2L2ALDH1A1
SCHEMBL8989867 0.70 PKM (0.70) MCOLN3PKMKEAP1NFE2L2MAPT
SCHEMBL8989846 0.70 MCOLN3 (0.63) MCOLN3PKMALDH1A1
SCHEMBL8989952 0.70 MCOLN3 (0.50) MCOLN3PKMKEAP1NFE2L2MAPT
SCHEMBL8989938 0.69 PKM (0.50) MCOLN3PKMKEAP1NFE2L2MAPT
SCHEMBL8989902 0.69 MCOLN3 (0.51) MCOLN3PKMKEAP1NFE2L2MAPT
SCHEMBL8989928 0.69 MMP3 (0.43) CAMK2ACAMK2GMMP3

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
US-5481005-A N-sulfonylindoline derivatives, their preparation and the pharmaceutical compositions in which they are present SANOFI (FR) 1996-01-02 US disclosed