SCHEMBL6017083

SCHEMBL6017083

C=CCNc1nc(NC2CCN(C)CC2)nc(N(C)c2ccc(OC)c(Cl)c2)n1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BCL6 P41182 1/20 0.47
EHMT2 Q96KQ7 16/20 0.45
KDM1A O60341 2/20 0.45
RCOR1 Q9UKL0 2/20 0.45
EHMT1 Q9H9B1 14/20 0.44

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
SCHEMBL6016637 0.88 EHMT2 (0.48) BCL6EHMT2KDM1ARCOR1EHMT1
SCHEMBL4839209 0.79 EHMT2 (0.50) BCL6EHMT2KDM1ARCOR1EHMT1
SCHEMBL4829652 0.78 BCL6 (0.47) BCL6EHMT2EHMT1
SCHEMBL6017073 0.77 EHMT2 (0.44) BCL6EHMT2KDM1ARCOR1EHMT1
SCHEMBL5457407 0.75 EHMT2 (0.53) BCL6EHMT2KDM1ARCOR1EHMT1
SCHEMBL14268378 0.75 DRD2 (0.42) BCL6
SCHEMBL6209798 0.75 CYP1A2 (0.46) BCL6
SCHEMBL5029049 0.73 MAPT (0.48) BCL6
SCHEMBL6608736 0.73 BCL6 (0.58) BCL6EHMT2EHMT1
SCHEMBL4838191 0.72 EHMT2 (0.49) BCL6EHMT2EHMT1

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