SCHEMBL5162492

SCHEMBL5162492

CS(=O)(=O)ON=C1C=CC(=O)C(C=N)=C1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.40
S1PR2 O95136 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.40
THRB P10828 1/20 0.40
PKM P14618 1/20 0.40
XBP1 P17861 1/20 0.40
ALOX12 P18054 1/20 0.40
MAPK1 P28482 1/20 0.40
MPI P34949 1/20 0.40
HTT P42858 1/20 0.40
RECQL P46063 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
APOBEC3G Q9HC16 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL5162508 0.77 MAPT (0.63) KDM4ES1PR2ALDH1A1LMNATP53
SCHEMBL5160310 0.76 KDM4E (0.43) KDM4ES1PR2ALDH1A1LMNATP53
SCHEMBL5160518 0.76 ALDH1A1 (0.47) KDM4ES1PR2ALDH1A1LMNATP53
SCHEMBL5162956 0.76 KDM4E (0.43) KDM4ES1PR2ALDH1A1LMNATP53
SCHEMBL5162910 0.72 KDM4E (0.40) KDM4ES1PR2ALDH1A1LMNATP53
SCHEMBL5163599 0.72 KDM4E (0.40) KDM4ES1PR2ALDH1A1LMNATP53
SCHEMBL5162444 0.72 ALDH1A1 (0.47) KDM4ES1PR2ALDH1A1LMNATP53
SCHEMBL5161513 0.71 KDM4E (0.40) KDM4ES1PR2ALDH1A1LMNATP53
SCHEMBL5160814 0.70 MIF (0.39) KDM4ES1PR2ALDH1A1LMNATP53
SCHEMBL5160406 0.70 KDM4E (0.39) KDM4ES1PR2ALDH1A1LMNATP53

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-1399114-B1 AGENT CONTAINING QUINONIMINE DERIVATIVES AND USED TO COLOUR KERATIN FIBRES, AND ASSOCIATED METHOD WELLA AG (DE) 2007-03-28 EP claimed