SCHEMBL14568632

SCHEMBL14568632

CNCCN(CCNC(=O)OC(C)(C)C)CCNC(=O)OC(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.50
MEN1 O00255 1/20 0.47
GAA P10253 1/20 0.47
KMT2A Q03164 1/20 0.47
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
CA12 O43570 6/20 0.42
CA1 P00915 6/20 0.42
CA2 P00918 5/20 0.42
CA9 Q16790 5/20 0.42
EPHX1 P07099 1/20 0.42
CKS1B P61024 1/20 0.40
SKP1 P63208 1/20 0.40
SKP2 Q13309 1/20 0.40
CA7 P43166 1/20 0.39
CA14 Q9ULX7 1/20 0.39
HTT P42858 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ALDH1A1 P00352 1/20 0.38
GFER P55789 1/20 0.38

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
SCHEMBL12482641 0.93 TDP1 (0.56) TDP1MEN1GAAKMT2AMAOA
SCHEMBL17209068 0.88 TDP1 (0.49) TDP1MEN1GAAKMT2AMAOA
SCHEMBL31165356 0.86 TDP1 (0.59) TDP1MEN1GAAKMT2AMAOA
SCHEMBL11346435 0.86 CA12 (0.50) TDP1MEN1GAAKMT2AMAOA
SCHEMBL2183642 0.86 TDP1 (0.59) TDP1MEN1GAAKMT2AMAOA
SCHEMBL2682165 0.84 TDP1 (0.49) TDP1MEN1GAAKMT2AMAOA
SCHEMBL3617075 0.84 MEN1 (0.50) TDP1MEN1GAAKMT2AMAOA
SCHEMBL3795861 0.84 TDP1 (0.49) TDP1MEN1GAAKMT2AMAOA
SCHEMBL270450 0.84 TDP1 (0.51) TDP1MEN1GAAKMT2AMAOA
SCHEMBL31420633 0.83 TDP1 (0.47) TDP1MEN1GAAKMT2AMAOA

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-2007027566-A2 METHOD FOR REMOVING PHOSPHATE AND POLYMER USED THEREFORE GENZYME CORPORATION (US) 2007-03-08 WO disclosed