SCHEMBL6451959

SCHEMBL6451959

CCn1cc(N(Cc2ccccc2)[C@H]2CCOC2)cn1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.36
POLB P06746 1/20 0.36
KMT2A Q03164 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
NPC1 O15118 1/20 0.35
HSP90AA1 P07900 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
SLC6A2 P23975 2/20 0.34
SLC6A4 P31645 2/20 0.34
SLC6A3 Q01959 2/20 0.34
BRD4 O60885 2/20 0.33
LMNA P02545 2/20 0.33
CREBBP Q92793 1/20 0.33
TGFBR1 P36897 1/20 0.33
PDE1A P54750 1/20 0.33
PDE1B Q01064 1/20 0.33
PDE1C Q14123 1/20 0.33
HDAC1 Q13547 1/20 0.32

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
SCHEMBL6450611 0.87 SLC6A2 (0.40) KMT2AMEN1RAB9ASMN1; SMN2SLC6A2
SCHEMBL6453841 0.84 SLC6A2 (0.39) KMT2ASMN1; SMN2SLC6A2SLC6A4SLC6A3
SCHEMBL6450409 0.81 MAPK1 (0.40) POLBKMT2AMEN1NPC1SMN1; SMN2
SCHEMBL6436864 0.80 DRD4 (0.37) KMT2AKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL6438072 0.79 HSD17B10 (0.45) POLBKMT2AKDM4EMEN1NPC1
SCHEMBL6440908 0.77 POLB (0.38) POLBKMT2AKDM4EMEN1PDE1B
SCHEMBL6440581 0.73 LMNA (0.41) PDE4BKMT2ALMNATGFBR1
SCHEMBL6456177 0.69 SLC6A2 (0.42) SLC6A2SLC6A4SLC6A3PGRDRD2
SCHEMBL9056947 0.69 SLC6A2 (0.42) SLC6A2SLC6A4SLC6A3PGRDRD2
SCHEMBL6469383 0.69 PDE4B (0.32) PDE4BTGFBR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1539753-A2 PYRAZOLO(3,4-B)PYRIDINE COMPOUNDS, AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS GLAXO GROUP LIMITED (GB) 2005-06-15 EP claimed
WO-2004024728-A2 PYRAZOLO[3,4-B]PYRIDINE COMPOUNDS, AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS GLAXO GROUP LIMITED (GB) 2004-03-25 WO claimed
EP-1539753-A2 PYRAZOLO(3,4-B)PYRIDINE COMPOUNDS, AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS GLAXO GROUP LIMITED (GB) 2005-06-15 EP disclosed
WO-2004024728-A2 PYRAZOLO[3,4-B]PYRIDINE COMPOUNDS, AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS GLAXO GROUP LIMITED (GB) 2004-03-25 WO disclosed