SCHEMBL4878707

SCHEMBL4878707

NN(C(=O)c1ccc(CNCc2ccccn2)cc1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.47
KDM4A O75164 1/20 0.45
KDM4B O94953 1/20 0.45
KDM5C P41229 1/20 0.45
KDM5B Q9UGL1 1/20 0.45
POLB P06746 2/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
LMNA P02545 1/20 0.45
ALDH1A1 P00352 3/20 0.45
KMT2A Q03164 3/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
MAPK14 Q16539 1/20 0.43
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
CA2 P00918 2/20 0.42
MEN1 O00255 2/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42

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
SCHEMBL29490421 0.80 PARP10 (0.57) L3MBTL1KDM4AKDM4BKDM5CKDM5B
SCHEMBL14005203 0.79 KMT2A (0.53) L3MBTL1KDM4AKDM4BKDM5CKDM5B
SCHEMBL14005183 0.79 KDM4A (0.46) L3MBTL1KDM4AKDM4BKDM5CKDM5B
SCHEMBL6018082 0.78 CXCR4 (0.49) L3MBTL1POLBNPC1RAB9ALMNA
SCHEMBL3314110 0.77 L3MBTL1 (0.62) L3MBTL1POLBALDH1A1KMT2ASMN1; SMN2
SCHEMBL29860055 0.77 L3MBTL1 (0.62) L3MBTL1POLBALDH1A1KMT2ASMN1; SMN2
SCHEMBL4743413 0.76 SMN1; SMN2 (0.57) L3MBTL1KDM4AKDM4BKDM5CKDM5B
SCHEMBL18322326 0.76 CYP1A2 (0.53) LMNAKMT2ASMN1; SMN2MAPK14HDAC8
SCHEMBL1169765 0.76 L3MBTL1 (0.57) L3MBTL1POLBNPC1RAB9ALMNA
SCHEMBL2947235 0.75 ALDH1A1 (0.63) L3MBTL1KDM4AKDM4BKDM5CKDM5B

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-2008112156-A1 CHEMOKINE RECEPTOR MODULATORS ALTIRIS THERAPEUTICS (US) 2008-09-18 WO disclosed