SCHEMBL11140691

SCHEMBL11140691

Nc1ccc(S(=O)(=O)O)c2ccc(/N=N/c3ccc([N+](=O)[O-])cc3O)c(O)c12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NT5E P21589 1/20 0.51
HSD17B10 Q99714 4/20 0.51
CYP1A2 P05177 3/20 0.51
CYP3A4 P08684 3/20 0.51
HPGD P15428 3/20 0.51
ALOX15 P16050 3/20 0.51
CYP2C9 P11712 3/20 0.51
CYP2C19 P33261 3/20 0.51
CYP2D6 P10635 2/20 0.51
TSHR P16473 2/20 0.51
ALOX12 P18054 1/20 0.51
CSNK2A1 P68400 1/20 0.51
MEN1 O00255 3/20 0.45
ALDH1A1 P00352 3/20 0.45
MAPT P10636 3/20 0.45
KMT2A Q03164 3/20 0.45
PRMT1 Q99873 1/20 0.45
LMNA P02545 1/20 0.45
POLB P06746 1/20 0.45
HTT P42858 1/20 0.45

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
SCHEMBL11140694 1.00 NT5E (0.51) NT5EHSD17B10CYP1A2CYP3A4HPGD
SCHEMBL28747688 0.89 CYP1A2 (0.54) NT5EHSD17B10CYP1A2CYP3A4HPGD
SCHEMBL11144285 0.86 CYP1A2 (0.46) NT5EHSD17B10CYP1A2CYP3A4HPGD
SCHEMBL414840 0.84 CYP1A2 (0.54) HSD17B10CYP1A2CYP3A4HPGDALOX15
SCHEMBL416249 0.83 CYP2C9 (0.56) NT5EHSD17B10CYP1A2CYP3A4HPGD
SCHEMBL11140524 0.78 MEN1 (0.39) NT5EHSD17B10CYP1A2CYP3A4HPGD
SCHEMBL28747674 0.77 CYP1A2 (0.59) HSD17B10CYP1A2CYP3A4HPGDALOX15
SCHEMBL9640449 0.77 CYP1A2 (0.59) HSD17B10CYP1A2CYP3A4HPGDALOX15
SCHEMBL29702447 0.77 CYP1A2 (0.59) HSD17B10CYP1A2CYP3A4HPGDALOX15
SCHEMBL9640482 0.77 CYP1A2 (0.59) HSD17B10CYP1A2CYP3A4HPGDALOX15

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-4416979-A DIFFUSION TRANSFER KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1983-11-22 US disclosed