SCHEMBL13253151

SCHEMBL13253151

C=C(C)C(=O)NCC(=O)NCC(=O)NC(CC(=O)OCC)C(=O)OCC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.43
KMT2A Q03164 3/20 0.42
POLB P06746 1/20 0.42
GAA P10253 3/20 0.37
MGAM O43451 1/20 0.36
SI P14410 1/20 0.36
MGAM2 Q2M2H8 1/20 0.36
PDE5A O76074 1/20 0.34
EGLN1 Q9GZT9 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
HTT P42858 1/20 0.32
CAD P27708 1/20 0.32
TGFBR1 P36897 1/20 0.32
NOD2 Q9HC29 2/20 0.32
PPID Q08752 1/20 0.32
ALDH1A1 P00352 2/20 0.32
TSHR P16473 1/20 0.32
MEN1 O00255 1/20 0.31

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
SCHEMBL12160526 0.83 EGLN1 (0.38) L3MBTL1KMT2APOLBGAAMGAM
SCHEMBL13253161 0.81 L3MBTL1 (0.48) L3MBTL1KMT2APOLBGAAMGAM
SCHEMBL14586331 0.75 CYP1A2 (0.52) L3MBTL1KMT2APOLBGAACYP1A2
SCHEMBL19566667 0.75 GAA (0.54) GAAMGAMSIMGAM2EGLN1
SCHEMBL468760 0.73 L3MBTL1 (0.50) L3MBTL1KMT2APOLBGAAMGAM
SCHEMBL468759 0.73 L3MBTL1 (0.50) L3MBTL1KMT2APOLBGAAMGAM
SCHEMBL13253157 0.72 L3MBTL1 (0.54) L3MBTL1KMT2APOLBGAAMGAM
SCHEMBL3868403 0.72 L3MBTL1 (0.54) L3MBTL1KMT2APOLBGAAMGAM
SCHEMBL28885656 0.72 KMT2A (0.59) L3MBTL1KMT2APOLBGAAMGAM
SCHEMBL28885647 0.72 KMT2A (0.59) L3MBTL1KMT2APOLBGAAMGAM

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-7754684-B2 Macromolecular platinum chelates ACCESS PHARMACEUTICALS, INC. (US) 2010-07-13 US disclosed