SCHEMBL6301442

SCHEMBL6301442

Cc1ccc(S(=O)(=O)N(Cc2ccccc2)c2ccc(O)cc2)cc1

nearest known ligand 0.81

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.81
NR3C1 P04150 2/20 0.72
ALDH1A1 P00352 1/20 0.72
LMNA P02545 1/20 0.72
NPSR1 Q6W5P4 1/20 0.72
CNR2 P34972 5/20 0.68
CNR1 P21554 3/20 0.68
PTGES O14684 4/20 0.66
ALOX5 P09917 3/20 0.66
MAPT P10636 1/20 0.63
NR1I2 O75469 1/20 0.60
ACHE P22303 1/20 0.59
GAA P10253 1/20 0.57
HTT P42858 1/20 0.57
PGR P06401 1/20 0.57

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
SCHEMBL6295367 0.90 ESR1 (0.88) ESR1NR3C1ALDH1A1LMNANPSR1
SCHEMBL27593108 0.90 ESR1 (1.00) ESR1NR3C1ALDH1A1LMNACNR2
SCHEMBL29262684 0.86 NR3C1 (0.72) ESR1NR3C1ALDH1A1LMNANPSR1
SCHEMBL6295935 0.85 ESR1 (0.67) ESR1NR3C1ALDH1A1LMNANPSR1
SCHEMBL6297504 0.81 ESR1 (0.87) ESR1ALDH1A1NPSR1CNR2CNR1
SCHEMBL5863215 0.81 ESR1 (0.72) ESR1NR3C1ALDH1A1LMNACNR2
SCHEMBL3257686 0.81 ACHE (0.73) ESR1NR3C1ALDH1A1LMNANPSR1
SCHEMBL5863377 0.80 NR3C1 (0.71) ESR1NR3C1ALDH1A1LMNANPSR1
SCHEMBL6864499 0.80 NR3C1 (0.57) ESR1NR3C1ALDH1A1LMNANPSR1
SCHEMBL15064934 0.80 CNR2 (1.00) NR3C1ALDH1A1LMNANPSR1CNR2

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-6921740-B1 Electron-receiving compound and thermal recording material MITSUBISHI PAPER MIILS LTD. (JP) 2005-07-26 US disclosed