SCHEMBL5482822

SCHEMBL5482822

NC1CCCCN1c1ccccn1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.42
PLD1 Q13393 1/20 0.41
ALDH1A1 P00352 4/20 0.41
HSD17B10 Q99714 1/20 0.41
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
GRM1 Q13255 1/20 0.39
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
MMP1 P03956 1/20 0.38
CYP1A2 P05177 1/20 0.38
GRM5 P41594 1/20 0.38
GRIN2D O15399 1/20 0.38
GRIN3B O60391 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2A Q12879 1/20 0.38
GRIN2B Q13224 1/20 0.38
GRIN2C Q14957 1/20 0.38
GRIN3A Q8TCU5 1/20 0.38

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
SCHEMBL27268114 0.80 LMNA (0.50) KDM4EALDH1A1MAPTHTTGRM1
SCHEMBL6262600 0.79 KDM4E (0.44) KDM4EPLD1ALDH1A1HSD17B10MAPT
SCHEMBL20336407 0.77 ALDH1A1 (0.42) KDM4EPLD1ALDH1A1HSD17B10MAPT
SCHEMBL11361290 0.77 KDM4E (0.38) KDM4EGRM5
SCHEMBL4555915 0.76 PLD1 (0.41) KDM4EPLD1ALDH1A1HSD17B10MAPT
SCHEMBL29782177 0.76 CHI3L1 (0.54) KDM4EPLD1ALDH1A1HSD17B10
SCHEMBL16238706 0.75 SMN1; SMN2 (0.52) KDM4EALDH1A1HSD17B10HTTGRM1
SCHEMBL30745929 0.75 HDAC6 (0.49) KDM4EALDH1A1HSD17B10MAPTHTT
SCHEMBL4919602 0.75 ALDH1A1 (0.43) KDM4EPLD1ALDH1A1HSD17B10MAPT
SCHEMBL14360624 0.75 HRH3 (0.50) KDM4EALDH1A1MAPTHTTGRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007109324-A2 POTENT AND SELECTIVE NAV 1.7 SODIUM CHANNEL BLOCKERS XENON PHARMACEUTICALS, INC. (CA) 2007-09-27 WO disclosed
US-5939553-A Process for preparing pyridine-2,6-diamines AKZO NOBEL N.V. (NL) 1999-08-17 US disclosed
EP-0825985-B1 A PROCESS FOR PREPARING PYRIDINE-2,6-DIAMINES AKZO NOBEL NV (NL) 1999-05-26 EP disclosed
EP-0825985-A1 A PROCESS FOR PREPARING PYRIDINE-2,6-DIAMINES Akzo Nobel N.V. (NL) 1998-03-04 EP disclosed
WO-1996036607-A1 A PROCESS FOR PREPARING PYRIDINE-2,6-DIAMINES AKZO NOBEL N.V. (NL) 1996-11-21 WO disclosed