SCHEMBL8729042

SCHEMBL8729042

CC(=O)OCCNc1c(Cl)c(Cl)nc(Cl)c1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.41
RECQL P46063 1/20 0.41
L3MBTL1 Q9Y468 3/20 0.40
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
HTT P42858 2/20 0.35
ALDH1A1 P00352 4/20 0.34
MAPT P10636 4/20 0.33
ATM Q13315 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
GAA P10253 2/20 0.33
CHRM5 P08912 2/20 0.33
CHRM1 P11229 2/20 0.33
CHRM3 P20309 2/20 0.33
LMNA P02545 2/20 0.33
TP53 P04637 2/20 0.33
THRB P10828 1/20 0.33
PGR P06401 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
SCHEMBL9862275 0.76 L3MBTL1 (0.46) KDM4ERECQLL3MBTL1MEN1KMT2A
SCHEMBL4775385 0.72 POLB (0.41) KDM4ERECQLL3MBTL1MEN1KMT2A
SCHEMBL8630497 0.71 KDM4E (0.37) KDM4ERECQLL3MBTL1MEN1KMT2A
SCHEMBL14544718 0.70 L3MBTL1 (0.51) KDM4ERECQLL3MBTL1MEN1KMT2A
SCHEMBL8630491 0.69 L3MBTL1 (0.46) KDM4ERECQLL3MBTL1MEN1KMT2A
SCHEMBL21600848 0.68 TP53 (0.42) KDM4ERECQLL3MBTL1KMT2ACYP1A2
SCHEMBL12884491 0.66
SCHEMBL14562388 0.66 ALDH1A1 (0.50) KDM4ERECQLL3MBTL1MEN1KMT2A
SCHEMBL68618 0.66 ALDH1A1 (0.50) KDM4ERECQLL3MBTL1MEN1KMT2A
SCHEMBL5950512 0.64 KDM4E (0.52) KDM4ERECQLL3MBTL1MEN1KMT2A

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-5824679-A Phosphanoxides--preparation and use BOEHRINGER MANNHEIM GMBH (DE) 1998-10-20 US disclosed