SCHEMBL14345644

SCHEMBL14345644

OCCN(CCO)CC(O)COC1=CC=C(C(c2ccc(OCC(O)CN(CCO)CCO)cc2)C(c2ccc(OCC(O)CN(CCO)CCO)cc2)c2ccc(OCC(O)CN(CCO)CCO)cc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 5/20 0.50
▸ ALDH1A1 P00352 4/20 0.49
▸ LMNA P02545 1/20 0.49
▸ NCOA3 Q9Y6Q9 1/20 0.48
▸ MAPK1 P28482 2/20 0.45
▸ MAPT P10636 2/20 0.45
▸ KDM4E B2RXH2 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.39
▸ TSHR P16473 2/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ POLB P06746 1/20 0.34
▸ HTT P42858 1/20 0.33
▸ HIF1A Q16665 1/20 0.33

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
SCHEMBL12403146 0.77 GAA (0.64) GAAALDH1A1LMNANCOA3MAPK1
SCHEMBL17300171 0.75 CYP1A2 (0.37) ALDH1A1LMNAMAPTNPSR1TSHR
SCHEMBL12403297 0.73 MAPK1 (0.52) GAAALDH1A1LMNANCOA3MAPK1
SCHEMBL31414645 0.72 ALDH1A1 (0.67) GAAALDH1A1LMNANCOA3MAPK1
SCHEMBL31414644 0.72 ALDH1A1 (0.67) GAAALDH1A1LMNANCOA3MAPK1
SCHEMBL11672344 0.69 MAPK1 (0.69) GAAALDH1A1LMNANCOA3MAPK1
SCHEMBL759782 0.69 ALDH1A1 (0.67) GAAALDH1A1LMNANCOA3MAPK1
SCHEMBL9636165 0.69 ALDH1A1 (0.62) GAAALDH1A1LMNANCOA3MAPK1
SCHEMBL12403459 0.69 ALDH1A1 (0.52) GAAALDH1A1LMNANCOA3MAPK1
SCHEMBL6018530 0.68 MAPK1 (0.55) GAAALDH1A1LMNANCOA3MAPK1

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-2007149501-A2 PROCESS FOR PREPARING DENDRITIC POLYMERS USING MICROWAVE ASSISTED SYNTHESIS DENDRITIC NANO TECHNOLOGIES, INC. (US) 2007-12-27 — — WO disclosed
Send feedback