SCHEMBL7204796

SCHEMBL7204796

CCC(O)(O)Nc1ccccc1NC(O)(O)CC

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CLCN2 P51788 1/20 0.38
GAA P10253 3/20 0.35
ALDH1A1 P00352 2/20 0.35
CA12 O43570 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
HTT P42858 2/20 0.33
LMNA P02545 1/20 0.33
KMT2A Q03164 1/20 0.33
CDC25A P30304 1/20 0.33
CDC25B P30305 1/20 0.33
CDC25C P30307 1/20 0.33
MAPT P10636 1/20 0.33
METTL3 Q86U44 1/20 0.33
MAPK1 P28482 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
SCHEMBL4965799 0.82 HPGD (0.51) GAAALDH1A1CA12CA9LMNA
SCHEMBL9399546 0.79 GAA (0.41) GAAKMT2AMAPT
SCHEMBL9563157 0.78 KMT2A (0.53) GAAALDH1A1LMNAKMT2AMAPT
SCHEMBL5360653 0.76 MEN1 (0.46) ALDH1A1LMNAKMT2AMAPTMAPK1
SCHEMBL6740884 0.75 CA12 (0.37) GAAALDH1A1CA12CA2CA9
SCHEMBL9853225 0.69 GAA (0.41) GAAALDH1A1HTTLMNAKMT2A
SCHEMBL17936482 0.69 MAPT (0.45) GAAALDH1A1HTTKMT2AMAPT
SCHEMBL29391961 0.68 ESR1 (0.45) GAAALDH1A1CA12CA2CA9
SCHEMBL6007829 0.67 RAB9A (0.39) GAAALDH1A1HTTLMNAKMT2A
SCHEMBL29881429 0.66 IDO1 (0.52) ALDH1A1HTTMAPT

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
US-6599987-B1 Compositions that are non-swellable in water after curing. In general, the compositions comprise a water soluble copolymers comprising vinylpyrrolidone and glycidyl acrylate and a water soluble secondary aromatic amine or aliphatic ring diamine. THE UNIVERSITY OF AKRON 2003-07-29 US disclosed