SCHEMBL6016976

SCHEMBL6016976

COc1ccc(Nc2nc(NC3CCCCCC3)nc(N(C)CCCN(C)c3ccccc3)n2)cc1Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL6 P41182 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.42
MAPT P10636 3/20 0.42
GAA P10253 1/20 0.42
RAB9A P51151 2/20 0.42
NPC1 O15118 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
LMNA P02545 1/20 0.41
KDM1A O60341 1/20 0.41
EHMT2 Q96KQ7 1/20 0.41
RCOR1 Q9UKL0 1/20 0.41
CTSL P07711 1/20 0.40
CTSS P25774 1/20 0.40
CTSK P43235 1/20 0.40
GALR2 O43603 1/20 0.39
GALR1 P47211 1/20 0.39
HTT P42858 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
ROCK1 Q13464 2/20 0.39

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
SCHEMBL4832789 0.91 BCL6 (0.53) BCL6SMN1; SMN2MAPTGAARAB9A
SCHEMBL4829657 0.88 BCL6 (0.51) BCL6SMN1; SMN2MAPTGAARAB9A
SCHEMBL6016978 0.84 BCL6 (0.48) BCL6SMN1; SMN2MAPTGAARAB9A
SCHEMBL4836573 0.82 BCL6 (0.68) BCL6SMN1; SMN2MAPTGAARAB9A
SCHEMBL6531588 0.80 BCL6 (0.58) BCL6SMN1; SMN2MAPTGAARAB9A
SCHEMBL4838143 0.80 BCL6 (0.54) BCL6SMN1; SMN2MAPTGAARAB9A
SCHEMBL4836855 0.80 BCL6 (0.54) BCL6SMN1; SMN2MAPTGAARAB9A
SCHEMBL4829781 0.79 RAB9A (0.65) BCL6SMN1; SMN2MAPTGAARAB9A
SCHEMBL4829776 0.79 BCL6 (0.59) BCL6SMN1; SMN2MAPTGAARAB9A
SCHEMBL14294401 0.79 RAB9A (0.46) BCL6SMN1; SMN2MAPTRAB9AMEN1

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-7132423-B2 Methods and compositions of novel triazine compounds REDDY US THERAPEUTICS, INC. (US) 2006-11-07 US claimed