SCHEMBL9645138

SCHEMBL9645138

Nc1cc(CF)c(S(=O)(=O)Oc2cccc3ccccc23)cc1S(=O)(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ ESR1 P03372 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ ESR2 Q92731 1/20 0.37
▸ TTR P02766 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ HPGD P15428 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ OGG1 O15527 1/20 0.34
▸ SENP2 Q9HC62 3/20 0.34
▸ SENP1 Q9P0U3 3/20 0.34
▸ SUMO2 P61956 2/20 0.34
▸ SUMO1 P63165 2/20 0.34
▸ SENP7 Q9BQF6 2/20 0.34
▸ SENP3 Q9H4L4 1/20 0.34
▸ HTR6 P50406 1/20 0.33
▸ HTR1B P28222 2/20 0.33
▸ HSD17B10 Q99714 1/20 0.33

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
SCHEMBL9646039 0.81 SLC7A11 (0.36) MEN1KMT2AGAATTRKDM4E
SCHEMBL9645144 0.75 ESR1 (0.42) MEN1KMT2AESR1GAAESR2
SCHEMBL28040872 0.75 KMT2A (0.50) MEN1KMT2AESR1GAAESR2
SCHEMBL11382698 0.72 ESR1 (0.39) MEN1KMT2AESR1GAAESR2
SCHEMBL28045820 0.70 TTR (0.57) MEN1KMT2ATTRKDM4EALDH1A1
SCHEMBL28963365 0.70 KMT2A (0.49) MEN1KMT2AESR1GAAESR2
SCHEMBL9645131 0.70 ESR1 (0.41) MEN1KMT2AESR1GAAESR2
SCHEMBL6099899 0.70 HTR6 (0.54) MEN1KMT2AESR1GAAESR2
SCHEMBL11577305 0.68 HTR6 (0.53) MEN1KMT2AESR1GAAESR2
Water SCHEMBL28963036 0.68 KMT2A (0.47) MEN1KMT2AESR1GAAESR2

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-5106960-A Fiber-reactive and monoazo red and yellow dyes; color- and washfastness; formaldehyde-resistance; brightness CIBA-GEIGY CORPORATION (US) 1992-04-21 — — US disclosed
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