SCHEMBL9190262

SCHEMBL9190262

Cc1cnc(C(=O)OB(OC(=O)c2ncc(C)nc2C)OC(=O)c2ncc(C)nc2C)c(C)n1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.35
JAK3 P52333 1/20 0.33
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
GRM5 P41594 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL4638784 0.76 JAK3 (0.35) POLBJAK3GRM5
SCHEMBL2491805 0.75 SMN1; SMN2 (0.40) POLBJAK3KMT2AGRM5
SCHEMBL7422568 0.75 HPGD (0.39) JAK3KMT2AMEN1TDP1GRM5
SCHEMBL30112052 0.75 HPGD (0.39) JAK3KMT2AMEN1TDP1GRM5
SCHEMBL29361842 0.75 SMN1; SMN2 (0.40) POLBJAK3KMT2AGRM5
SCHEMBL5069987 0.74 JAK3 (0.34) POLBJAK3GRM5
SCHEMBL30509867 0.73 SIRT3 (0.37) POLBJAK3TDP1GRM5
SCHEMBL3460085 0.73 SIRT3 (0.37) POLBJAK3TDP1GRM5
SCHEMBL11201451 0.70 MAPKAPK2 (0.35) POLBJAK3KMT2AGRM5L3MBTL1
SCHEMBL24090784 0.70 POLB (0.55) POLBKMT2ATDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0636110-A4 PROCESS FOR DECREASING CHLORINE CONTENT OF CHLORINATED HYDROCARBONS. UNIV PRINCETON (US) 1995-03-15 EP disclosed
EP-0636110-A1 PROCESS FOR DECREASING CHLORINE CONTENT OF POLYCHLORINATED HYDROCARBONS THE TRUSTEES OF PRINCETON UNIVERSITY (US) 1995-02-01 EP disclosed
WO-1993021117-A1 PROCESS FOR DECREASING CHLORINE CONTENT OF CHLORINATED HYDROCARBONS THE TRUSTEES OF PRINCETON UNIVERSITY (US) 1993-10-28 WO disclosed