SCHEMBL9970205

SCHEMBL9970205

CC(C)(C)c1ccc2[nH]c(CCCCN(C[C@H]3OC(n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)S(C)(=O)=O)nc2c1

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DOT1L Q8TEK3 15/20 0.61
DNMT1 P26358 1/20 0.51
AMD1 P17707 1/20 0.50

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
SCHEMBL9940700 1.00 DOT1L (0.61) DOT1LDNMT1AMD1
SCHEMBL9940701 1.00 DOT1L (0.61) DOT1LDNMT1AMD1
SCHEMBL15395669 0.91 DOT1L (0.51) DOT1LDNMT1
SCHEMBL19111255 0.90 DOT1L (0.66) DOT1LDNMT1
SCHEMBL9940528 0.90 DOT1L (0.66) DOT1LDNMT1
SCHEMBL14873790 0.90 DOT1L (0.66) DOT1LDNMT1
SCHEMBL9940505 0.89 DOT1L (0.49) DOT1LDNMT1AMD1
SCHEMBL9970201 0.87 DOT1L (0.58) DOT1L
SCHEMBL9940637 0.87 DOT1L (0.58) DOT1L
SCHEMBL9940737 0.86 DOT1L (0.59) DOT1L

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-2012082436-A2 MODULATORS OF HISTONE METHYLTRANSFERASE, AND METHODS OF USE THEREOF Epizyme, Inc. (US) 2012-06-21 WO disclosed