SCHEMBL14742161

SCHEMBL14742161

CN(C)CCCOC(=O)c1c[nH]cn1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.51
ALDH1A1 P00352 5/20 0.48
TSHR P16473 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MAPK1 P28482 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MAPT P10636 2/20 0.39
LMNA P02545 2/20 0.38
PHLPP2 Q6ZVD8 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.36
APP P05067 1/20 0.36
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL22372188 0.91 PHLPP2 (0.45) GAAALDH1A1MAPK1HSD17B10MAPT
SCHEMBL3008544 0.83 LMNA (0.54) ALDH1A1TSHRL3MBTL1MAPK1HSD17B10
SCHEMBL3004724 0.82 LMNA (0.49) ALDH1A1TSHRL3MBTL1MAPK1HSD17B10
SCHEMBL3010778 0.81 LMNA (0.50) ALDH1A1TSHRMAPK1HSD17B10MAPT
SCHEMBL13092513 0.81 LMNA (0.50) ALDH1A1TSHRMAPK1HSD17B10MAPT
SCHEMBL2995184 0.81 LMNA (0.50) ALDH1A1TSHRMAPK1HSD17B10MAPT
SCHEMBL3006729 0.81 LMNA (0.50) ALDH1A1TSHRMAPK1HSD17B10MAPT
SCHEMBL28575733 0.80 LMNA (0.37) ALDH1A1TSHRL3MBTL1MAPTLMNA
SCHEMBL25475161 0.80 FNTA (0.33) ALDH1A1MAPTLMNASMN1; SMN2APP
SCHEMBL3015836 0.80 ALDH1A1 (0.44) ALDH1A1TSHRHSD17B10MAPTLMNA

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-2013033046-A2 FLUORESCENT PL MARKERS FOR ISOELECTRIC FOCUSING SEPARATIONS AND FLUORESCENT LABELING VIGH GYULA (US) 2013-03-07 WO disclosed