SCHEMBL7721806

SCHEMBL7721806

COOC(OC)(C(O)CN1CCOCC1)C(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 14/20 0.45
KMT2A Q03164 14/20 0.45
HTT P42858 1/20 0.44
ATM Q13315 1/20 0.43
NPC1 O15118 2/20 0.43
POLB P06746 1/20 0.43
PKM P14618 1/20 0.41

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
SCHEMBL7721796 0.88 NPSR1 (0.44) MEN1KMT2APOLB
SCHEMBL7620791 0.72 HTT (0.33) KMT2AHTT
SCHEMBL8459470 0.69 RAB9A (0.34) MEN1KMT2APOLBPKM
SCHEMBL4882542 0.67 MEN1 (0.71) MEN1KMT2ANPC1
SCHEMBL7145599 0.66 KIF11 (0.38)
SCHEMBL8231523 0.66 MEN1 (0.44) MEN1KMT2AHTTATMNPC1
SCHEMBL7721803 0.65 CYP2D6 (0.58) MEN1KMT2AHTTPOLBPKM
SCHEMBL7142440 0.65 TSHR (0.50) HTTPOLB
SCHEMBL17771716 0.65 POLB (0.55) MEN1KMT2AHTTNPC1POLB
SCHEMBL17028079 0.64 ALDH1A1 (0.56) MEN1KMT2AHTTATMNPC1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0739351-B1 MONOMERIC DIOLS AND PHOSPHATE LINKED OLIGOMERS FORMED THEREFROM ISIS PHARMACEUTICALS INC (US) 2002-04-10 EP disclosed
US-5886177-A ETHYLENE GLYCOL MONOMERS JOINED VIA STANDARD PHOSPHATE LINKAGES INCLUDING PHOSPHOROTHIOATE, PHOSPHODIESTER, AND PHOSPHORAMIDATE LINKAGES; USEFUL FUNCTIONAL GROUPS INCLUDE NUCLEOBASES AS WELL AS POLAR GROUPS, HYDROPHOBIC GROUPS ISIS PHARMACEUTICALS, INC. (US) 1999-03-23 US disclosed
EP-0739351-A4 MONOMERIC DIOLS AND PHOSPHATE LINKED OLIGOMERS FORMED THEREFROM ISIS PHARMACEUTICALS INC (US) 1998-10-21 EP disclosed
EP-0739351-A1 MONOMERIC DIOLS AND PHOSPHATE LINKED OLIGOMERS FORMED THEREFROM ISIS PHARMACEUTICALS, INC. (US) 1996-10-30 EP disclosed
WO-1995018820-A1 MONOMERIC DIOLS AND PHOSPHATE LINKED OLIGOMERS FORMED THEREFROM ISIS PHARMACEUTICALS, INC. (US) 1995-07-13 WO disclosed