SCHEMBL8490607

SCHEMBL8490607

COC(=O)c1ccc2ccc(C(=O)N(O)c3ccc(N(O)C(=O)c4ccc5ccc(C(=O)OC)cc5c4)cc3)cc2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.50
HTT P42858 2/20 0.50
LCK P06239 1/20 0.48
PTPN11 Q06124 2/20 0.47
KDM4E B2RXH2 5/20 0.45
HPGD P15428 4/20 0.45
CA12 O43570 2/20 0.45
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
CA7 P43166 2/20 0.45
CA9 Q16790 2/20 0.45
CA14 Q9ULX7 2/20 0.45
XDH P47989 1/20 0.45
MAPT P10636 5/20 0.43
CYP3A4 P08684 1/20 0.43
CYP19A1 P11511 1/20 0.42
CYP11B1 P15538 1/20 0.42
CYP11B2 P19099 1/20 0.42
ALDH1A1 P00352 4/20 0.41
HSD17B10 Q99714 3/20 0.41

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
SCHEMBL709231 0.83 LCK (0.62) ALOX15HTTLCKPTPN11KDM4E
SCHEMBL9362116 0.81 PLAU (0.47) ALOX15HTTPTPN11KDM4EHPGD
SCHEMBL9361252 0.81 KDM4E (0.52) ALOX15HTTKDM4EHPGDCA1
SCHEMBL3149026 0.79 LCK (0.49) ALOX15HTTLCKPTPN11KDM4E
SCHEMBL17681583 0.78 HPGD (0.64) KDM4EHPGDCA12CA1CA2
SCHEMBL9979782 0.77 PTPN11 (0.64) ALOX15HTTLCKPTPN11KDM4E
SCHEMBL29365729 0.77 PTPN11 (0.68) ALOX15HTTLCKPTPN11KDM4E
SCHEMBL69025 0.77 PTPN11 (0.68) ALOX15HTTLCKPTPN11KDM4E
SCHEMBL27785147 0.77 LCK (0.53) ALOX15HTTLCKPTPN11KDM4E
SCHEMBL3018277 0.76 KDM4E (0.59) ALOX15HTTLCKPTPN11KDM4E

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
EP-0913430-A1 CONDENSED AZO COMPOUND AND PROCESS FOR PRODUCING THE SAME KABUSHIKI KAISHA UENO SEIYAKU OYO KENKYUJO (JP) 1999-05-06 EP disclosed