SCHEMBL28001063

SCHEMBL28001063

CCOCOc1ccc(Cl)c(Cl)c1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.51
ALDH1A1 P00352 5/20 0.44
LMNA P02545 1/20 0.44
KCNH2 Q12809 1/20 0.43
NQO1 P15559 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
GRM5 P41594 1/20 0.42
FFAR1 O14842 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HSP90AA1 P07900 1/20 0.39
MRGPRX4 Q96LA9 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
FFAR4 Q5NUL3 1/20 0.38

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
SCHEMBL1548013 0.84 KDM4E (0.58) KDM4EALDH1A1LMNAKCNH2NQO1
SCHEMBL8751807 0.81 NQO1 (0.63) KDM4EALDH1A1NQO1SMN1; SMN2
SCHEMBL15114753 0.80 KDM4E (0.50) KDM4EALDH1A1LMNAKCNH2SMN1; SMN2
SCHEMBL27730066 0.79 NQO1 (0.50) KDM4EALDH1A1LMNAKCNH2NQO1
SCHEMBL23216195 0.78 KDM4E (0.45) KDM4EALDH1A1LMNAKCNH2SMN1; SMN2
SCHEMBL29512405 0.78 KDM4E (0.45) KDM4EALDH1A1LMNAKCNH2SMN1; SMN2
SCHEMBL13969487 0.77 LTA4H (0.57) KDM4EKCNH2NQO1FFAR1HSP90AA1
SCHEMBL12885024 0.76 KDM4E (0.69) KDM4EALDH1A1LMNAKCNH2SMN1; SMN2
SCHEMBL13261015 0.76 KDM4E (0.64) KDM4EALDH1A1LMNAKCNH2SMN1; SMN2
SCHEMBL24854715 0.76 KMT2A (0.51) KDM4ELMNAKCNH2SMN1; SMN2GRM5

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
CN-104447792-A Substituted dihydro and tetrahydro oxazolopyrimidinones, preparation and use thereof SANOFI AVENTIS 2015-03-25 CN disclosed