SCHEMBL20007755

SCHEMBL20007755

CCOC(=O)C(CCNC)C(=O)OCC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 5/20 0.42
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
MGAM O43451 1/20 0.41
GAA P10253 1/20 0.41
SI P14410 1/20 0.41
MGAM2 Q2M2H8 1/20 0.41
POLB P06746 2/20 0.40
ALDH1A1 P00352 3/20 0.39
L3MBTL1 Q9Y468 3/20 0.38
MMP8 P22894 1/20 0.38
TSHR P16473 2/20 0.37
MAPK1 P28482 2/20 0.37
LMNA P02545 1/20 0.37
HSD17B10 Q99714 1/20 0.37
ALOX15 P16050 1/20 0.36
SOAT1 P35610 1/20 0.36
MAPT P10636 1/20 0.36
CRHBP P24387 1/20 0.36
CRHR2 Q13324 1/20 0.36

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
SCHEMBL19223347 0.86 TDP1 (0.46) TDP1KMT2AMEN1MGAMGAA
SCHEMBL4613905 0.81 TDP1 (0.50) TDP1KMT2AMEN1MGAMGAA
SCHEMBL15726352 0.81 TDP1 (0.41) TDP1KMT2AMEN1MGAMGAA
SCHEMBL19441166 0.81 GAA (0.39) KMT2AMEN1MGAMGAASI
Dimethylamine SCHEMBL15711059 0.80 TDP1 (0.43) TDP1KMT2AMEN1MGAMGAA
SCHEMBL18307599 0.79 CA1 (0.46) KMT2AMEN1MGAMGAASI
SCHEMBL8535256 0.78 ADH1B (0.41) TDP1KMT2AMEN1MGAMGAA
SCHEMBL15033661 0.78 CPB2 (0.38) KMT2AMEN1MGAMGAASI
SCHEMBL11655565 0.77 TDP1 (0.56) TDP1KMT2AMEN1MGAMGAA
SCHEMBL7659602 0.77 TDP1 (0.56) TDP1KMT2AMEN1MGAMGAA

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-2740738-B1 PLATINUM COMPOUNDS FOR TREATING CELL PROLIFERATIVE DISEASE, PREPARATION METHODS AND USES THEREOF BEIJING FSWELCOME TECH DEVELOPMENT CO LTD (CN) 2018-03-28 EP disclosed