SCHEMBL14878166

SCHEMBL14878166

CCCOc1cccc(N(CC(=O)N(C)C)S(=O)(=O)c2ccccc2)c1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 2/20 0.49
NFE2L2 Q16236 2/20 0.49
HTT P42858 3/20 0.48
LMNA P02545 3/20 0.48
GAA P10253 2/20 0.48
USP2 O75604 1/20 0.48
F2 P00734 2/20 0.47
KAT6A Q92794 1/20 0.47
KMT2A Q03164 4/20 0.47
ESR1 P03372 1/20 0.46
MAPT P10636 4/20 0.45
MEN1 O00255 2/20 0.45
PKM P14618 1/20 0.44
HPGD P15428 1/20 0.44

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
SCHEMBL14878119 0.87 NR1I2 (0.57) KEAP1NFE2L2HTTLMNAGAA
SCHEMBL8151104 0.84 F2 (0.42) KEAP1NFE2L2HTTLMNAGAA
SCHEMBL14878167 0.81 KMT2A (0.61) HTTLMNAUSP2KMT2AMAPT
SCHEMBL14878181 0.81 F2 (0.67) F2KAT6AKMT2AMEN1
SCHEMBL7327551 0.76 ESR1 (0.55) HTTLMNAGAAUSP2KMT2A
SCHEMBL7328822 0.76 ESR1 (0.54) KEAP1NFE2L2HTTLMNAGAA
SCHEMBL7335466 0.75 ESR1 (0.59) KEAP1NFE2L2LMNAKMT2AESR1
SCHEMBL7333708 0.74 MAPT (0.60) LMNAMAPTPKM
SCHEMBL7329319 0.73 F2 (0.54) HTTGAAF2KMT2AMAPT
SCHEMBL7335613 0.72 RAB9A (0.51) HTTLMNAGAAUSP2KMT2A

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-8426433-B2 Anticoagulant compounds, pharmaceutical compositions on their basis to treat thrombotic conditions, and plasma-substituting solution to correct hypercoagulation defects of hemodilution Obschestvo S Ogranichennoi Otvetsttvennoctiyu “Bionika” (RU) 2013-04-23 US disclosed