SCHEMBL3245301

SCHEMBL3245301

C=CCOCC(COCCOCCO)OCCOCCO

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.36
TSHR P16473 2/20 0.36
MAPK1 P28482 1/20 0.36
THRB P10828 1/20 0.33
HTT P42858 1/20 0.33
MAPT P10636 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
SCHEMBL26483457 0.95 CA1 (0.36) MEN1KMT2ACA1CA2CA7
SCHEMBL3247650 0.93 CA1 (0.41) MEN1KMT2ACA1CA2CA7
SCHEMBL12937834 0.86 CA1 (0.37) MEN1KMT2ACA1CA2CA7
SCHEMBL26483451 0.85 CA1 (0.39) MEN1KMT2ACA1CA2CA7
SCHEMBL19543624 0.84 MEN1 (0.55) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL16248431 0.84 MEN1 (0.55) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL12317025 0.84 MEN1 (0.55) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL17932926 0.84 MEN1 (0.55) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL15353970 0.84 MEN1 (0.55) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL21855423 0.84 MEN1 (0.55) MEN1KMT2ATSHRMAPK1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1268584-B1 COMPOSITIONS AND METHODS FOR SELECTIVELY BINDING AMINES OR AMINO ACID ENANTIOMERS OVER THEIR COUNTER-ENANTIOMERS IBC ADVANCED TECH INC (US) 2010-05-05 EP disclosed
US-6686479-B2 SEPARATION OF ENANTIOMORPHS IBC ADVANCED TECHNOLOGIES, INC. 2004-02-03 US disclosed
EP-1268584-A4 COMPOSITIONS AND METHODS FOR SELECTIVELY BINDING AMINES OR AMINO ACID ENANTIOMERS OVER THEIR COUNTER-ENANTIOMERS IBC ADVANCED TECH INC (US) 2003-06-18 EP disclosed
EP-1268584-A1 COMPOSITIONS AND METHODS FOR SELECTIVELY BINDING AMINES OR AMINO ACID ENANTIOMERS OVER THEIR COUNTER-ENANTIOMERS IBC ADVANCED TECHNOLOGIES, INC. (US) 2003-01-02 EP disclosed
US-20020019491-A1 Compositons and methods for selectively binding amines or amino acid enantiomers over their counter-enantiomers IBC ADVANCED TECHNOLOGIES, INC. 2002-02-14 US disclosed
WO-2001068729-A1 COMPOSITIONS AND METHODS FOR SELECTIVELY BINDING AMINES OR AMINO ACID ENANTIOMERS OVER THEIR COUNTER-ENANTIOMERS IBC ADVANCED TECHNOLOGIES, INC. (US) 2001-09-20 WO disclosed