SCHEMBL14965341

SCHEMBL14965341

O=C(Nc1nc(N2C3CCC2CC(NC2CCC2)C3)c2c(-c3ccccc3)csc2n1)C1CCNC1

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 2/20 0.38
ADORA3 P0DMS8 1/20 0.36
ADORA2A P29274 1/20 0.36

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
SCHEMBL14965003 0.90 ADORA3 (0.37) ADORA1ADORA3ADORA2A
SCHEMBL14965112 0.88 ALDH1A1 (0.38)
SCHEMBL14965152 0.86 ADORA1 (0.37) ADORA1ADORA3ADORA2A
SCHEMBL14965245 0.79 LMNA (0.49)
SCHEMBL14964954 0.79 PTK2 (0.34)
SCHEMBL14964851 0.78 SMN1; SMN2 (0.38)
SCHEMBL14965271 0.76 PTK2 (0.47)
SCHEMBL14965320 0.76 PTK2 (0.45)
SCHEMBL14965062 0.76 PTK2 (0.40)
SCHEMBL14964875 0.76 SMN1; SMN2 (0.38)

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-2780343-A1 THIENO- AND FURO - PYRIMIDINES AND PYRIDINES, USEFUL AS POTASSIUM CHANNEL INHIBITORS Xention Limited (GB) 2014-09-24 EP disclosed
WO-2013072694-A1 THIENO- AND FURO - PYRIMIDINES AND PYRIDINES, USEFUL AS POTASSIUM CHANNEL INHIBITORS XENTION LIMITED (GB) 2013-05-23 WO disclosed