SCHEMBL11245129

SCHEMBL11245129

CC(=O)OCC(N)(CO)CO.OCC(CO)(CO)CO

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 4/20 0.36
HSD17B10 Q99714 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
TP53 P04637 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPK1 P28482 1/20 0.35
HIF1A Q16665 1/20 0.35
KDM4E B2RXH2 1/20 0.32
POLB P06746 1/20 0.32
GALR3 O60755 1/20 0.31
PGR P06401 1/20 0.30
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
HTR1A P08908 1/20 0.30
CHRM5 P08912 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRNB2 P17787 1/20 0.30

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
SCHEMBL1762048 0.94 LMNA (0.41) LMNAMEN1KMT2AALDH1A1HSD17B10
SCHEMBL12191370 0.89 LMNA (0.41) LMNAMEN1KMT2AALDH1A1HSD17B10
SCHEMBL28232410 0.83 ALDH1A1 (0.41) LMNAMEN1KMT2AALDH1A1HSD17B10
SCHEMBL4688117 0.82 ALDH1A1 (0.46) LMNAALDH1A1HSD17B10SMN1; SMN2GALR3
SCHEMBL11884235 0.81 TSHR (0.40) LMNAMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL11249412 0.80 NAAA (0.34) LMNAMEN1KMT2AALDH1A1SMN1; SMN2
Hydrochloric Acid SCHEMBL4955070 0.80 ALDH1A1 (0.43) LMNAALDH1A1HSD17B10SMN1; SMN2GALR3
SCHEMBL725624 0.80 ALDH1A1 (0.46) LMNAALDH1A1HSD17B10SMN1; SMN2TP53
SCHEMBL832777 0.80 ALDH1A1 (0.52) LMNAALDH1A1HSD17B10SMN1; SMN2TP53
SCHEMBL10584206 0.80 ALDH1A1 (0.46) LMNAALDH1A1HSD17B10SMN1; SMN2TP53

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-4342875-A STABILIZERS FOR OLEFIN POLYMERS CINCINNATI-MILACRON, INC. (US) 1982-08-03 US disclosed