SCHEMBL12484355

SCHEMBL12484355

C=CCc1cc(N(CC)CC)nc(Cl)n1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.42
KDM4E B2RXH2 1/20 0.42
CRHR1 P34998 2/20 0.33
HTT P42858 1/20 0.33
MEN1 O00255 1/20 0.33
GBA1 P04062 1/20 0.31

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
SCHEMBL12483305 0.81 KMT2A (0.49) KMT2AKDM4ECRHR1HTTMEN1
SCHEMBL10849722 0.80 KMT2A (0.51) KMT2AKDM4ECRHR1HTTMEN1
SCHEMBL12485791 0.78 KMT2A (0.46) KMT2AKDM4ECRHR1HTTMEN1
SCHEMBL12485725 0.75 KMT2A (0.44) KMT2AKDM4ECRHR1HTTMEN1
SCHEMBL12484176 0.75 KMT2A (0.44) KMT2AKDM4ECRHR1HTTMEN1
SCHEMBL12483838 0.74 KMT2A (0.42) KMT2AKDM4ECRHR1HTTMEN1
SCHEMBL17386207 0.74 KMT2A (0.41) KMT2AKDM4EHTTMEN1
SCHEMBL1603021 0.73 KMT2A (0.67) KMT2AKDM4ECRHR1HTTMEN1
SCHEMBL12485046 0.73 HSP90AB1 (0.31)
SCHEMBL12484926 0.73 KMT2A (0.41) KMT2AKDM4E

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-2012115479-A2 DIAMINOPYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2012-08-30 WO disclosed