SCHEMBL2015833

SCHEMBL2015833

O=CCc1cc(F)c2cccnc2c1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.53
L3MBTL1 Q9Y468 6/20 0.53
ALDH1A1 P00352 5/20 0.53
MEN1 O00255 5/20 0.53
KMT2A Q03164 5/20 0.53
TDP1 Q9NUW8 4/20 0.53
LMNA P02545 3/20 0.53
MAPT P10636 3/20 0.53
IDO1 P14902 2/20 0.53
TDO2 P48775 2/20 0.53
POLB P06746 1/20 0.53
THRB P10828 1/20 0.53
PKM P14618 1/20 0.53
RECQL P46063 1/20 0.53
BLM P54132 1/20 0.53
CASP6 P55212 1/20 0.53
MPI P34949 1/20 0.46
HIF1A Q16665 2/20 0.46
HSD17B10 Q99714 2/20 0.46
CYP2D6 P10635 1/20 0.46

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
SCHEMBL10157048 0.89 COMT (0.49) KDM4EL3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL737088 0.86 KDM4E (0.50) KDM4EL3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL2014459 0.83 CDK1 (0.62) KDM4EL3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL2013981 0.83 HTT (0.46) KDM4EL3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL739954 0.78 L3MBTL1 (0.51) KDM4EL3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL2015218 0.77 CDC7 (0.40) KDM4EL3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL16207365 0.76 KDM4E (0.62) KDM4EL3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL2017535 0.74 MAPT (0.41) KDM4EL3MBTL1ALDH1A1MAPTMPI
SCHEMBL2018360 0.73 SLC40A1 (0.36) KDM4EL3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL9056804 0.73 KDM4E (0.68) KDM4EL3MBTL1ALDH1A1MEN1KMT2A

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
WO-2011075630-A1 SUBSTITUTED FUSED ARYL AND HETEROARYL DERIVATIVES AS PI3K INHIBITORS INCYTE CORPORATION (US) 2011-06-23 WO disclosed