SCHEMBL6202647

SCHEMBL6202647

CN(C)C1CCN(C(=O)c2ccncc2)C1

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL3 Q96JM7 2/20 0.67
RECQL P46063 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.55
HRH3 Q9Y5N1 6/20 0.54
GAA P10253 2/20 0.53
NPC1 O15118 1/20 0.51
PDK2 Q15119 1/20 0.49
JAK2 O60674 1/20 0.48
MCHR1 Q99705 1/20 0.48
KDM4E B2RXH2 1/20 0.48
POLB P06746 1/20 0.48
CHRNB2 P17787 1/20 0.48
CHRNB4 P30926 1/20 0.48
CHRNA3 P32297 1/20 0.48
CHRNA7 P36544 1/20 0.48
CHRNA4 P43681 1/20 0.48
MALT1 Q9UDY8 1/20 0.47

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
SCHEMBL5909215 1.00 L3MBTL3 (0.67) L3MBTL3RECQLL3MBTL1HRH3GAA
SCHEMBL5165696 0.93 L3MBTL3 (0.62) L3MBTL3RECQLL3MBTL1HRH3JAK2
SCHEMBL10293598 0.86 L3MBTL3 (0.69) L3MBTL3L3MBTL1HRH3PDK2KDM4E
SCHEMBL10293555 0.86 L3MBTL3 (0.69) L3MBTL3L3MBTL1HRH3PDK2KDM4E
SCHEMBL24185235 0.85 L3MBTL3 (0.71) L3MBTL3L3MBTL1HRH3PDK2JAK2
SCHEMBL12237837 0.85 L3MBTL3 (0.71) L3MBTL3L3MBTL1HRH3PDK2
SCHEMBL12237840 0.85 L3MBTL3 (0.71) L3MBTL3L3MBTL1HRH3PDK2
SCHEMBL2887400 0.85 L3MBTL3 (0.71) L3MBTL3L3MBTL1HRH3PDK2JAK2
SCHEMBL10195734 0.85 L3MBTL3 (0.71) L3MBTL3L3MBTL1HRH3PDK2
SCHEMBL24185230 0.85 L3MBTL3 (0.71) L3MBTL3L3MBTL1HRH3PDK2JAK2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1494672-A1 AMINOCARBONYL SUBSTITUTED PYRIDINES, PYRIDAZINES, PYRIMIDINES, PYRAZINES AND TRIAZINES HAVING ANTIANGIOGENIC ACTIVITY Abbott Laboratories (US) 2005-01-12 EP disclosed
WO-2003086398-A1 AMINOCARBONYL SUBSTITUTED PYRIDINES, PYRIDAZINES, PYRIMIDINES, PYRAZINES AND TRIAZINES HAVING ANTIANGIOGENIC ACTIVITY ABBOTT LABORATORIES (US) 2003-10-23 WO disclosed