SCHEMBL8313849

SCHEMBL8313849

CCON=C1CCC(NC)CC1

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 1/20 0.34

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
SCHEMBL8312883 0.78 DRD2 (0.34)
SCHEMBL12949141 0.78 CHRM3 (0.37) CHRM3
SCHEMBL12928650 0.76 CHRM3 (0.36) CHRM3
SCHEMBL8309553 0.76 CHRM3 (0.36) CHRM3
SCHEMBL12083995 0.73 ALDH1A1 (0.44) CHRM3
SCHEMBL11382530 0.73 CYP1A2 (0.35)
SCHEMBL12465180 0.72
SCHEMBL7541983 0.70 KMT2A (0.36) CHRM3
SCHEMBL8341325 0.69 TSHR (0.40)
SCHEMBL13606807 0.67 ESR2 (0.40) CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1581532-B1 PYRAZOLO¬3,4-B PYRIDINE COMPOUNDS, AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS GLAXO GROUP LTD (GB) 2010-04-28 EP disclosed
WO-2004056823-A1 PYRAZOLO[3,4-b]PYRIDINE COMPOUNDS, AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS GLAXO GROUP LIMITED (GB) 2004-07-08 WO 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