SCHEMBL6825407

SCHEMBL6825407

CCOC(=O)CNCC1CCCC1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.45
MGAM O43451 1/20 0.45
SI P14410 1/20 0.45
MGAM2 Q2M2H8 1/20 0.45
KDM4E B2RXH2 2/20 0.43
POLB P06746 1/20 0.43
KMT2A Q03164 1/20 0.41
CYP2D6 P10635 2/20 0.41
EPHX2 P34913 1/20 0.41
THRB P10828 1/20 0.39
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
EPHX1 P07099 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ADH1B P00325 1/20 0.38
ADH1C P00326 1/20 0.38
ADH1A P07327 1/20 0.38
ADH4 P08319 1/20 0.38
ADH7 P40394 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
SCHEMBL7333520 0.98 KDM4E (0.46) GAAMGAMSIMGAM2KDM4E
SCHEMBL5232716 0.92 GAA (0.48) GAAMGAMSIMGAM2POLB
SCHEMBL2810358 0.82 EPHX2 (0.49) KDM4EPOLBKMT2ACYP2D6EPHX2
SCHEMBL4662750 0.81 EPHX2 (0.51) KDM4EPOLBKMT2ACYP2D6EPHX2
SCHEMBL9544427 0.81 EPHX2 (0.51) KDM4EPOLBKMT2ACYP2D6EPHX2
SCHEMBL22096239 0.81 EPHX2 (0.51) KDM4EPOLBKMT2ACYP2D6EPHX2
SCHEMBL3197578 0.81 KDM4E (0.44) GAAMGAMSIMGAM2KDM4E
SCHEMBL1439129 0.80 TDP1 (0.48) GAAMGAMSIMGAM2POLB
SCHEMBL3115331 0.80 GAA (0.43) GAAMGAMSIMGAM2KMT2A
SCHEMBL25311355 0.79 TDP1 (0.50) GAAMGAMSIMGAM2POLB

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-2004087643-A1 DEFORMYLASE INHIBITOR, PROCESS FOR PREPARING THE SAME, AND ANTIBACTERIAL COMPOSITION COMPRISING THE SAME PROMEDITECH INC. (KR) 2004-10-14 WO disclosed