SCHEMBL1875007

SCHEMBL1875007

CCCn1c(Oc2cccc(OC)c2)nc(=O)c2c1N=C(C1CCCCC1)[N]2

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 12/20 0.55
ADORA3 P0DMS8 1/20 0.55
ADORA2B P29275 2/20 0.44
DRD2 P14416 2/20 0.39
ALPL P05186 1/20 0.36
KDM2B Q8NHM5 1/20 0.35
ADORA2A P29274 1/20 0.35

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
SCHEMBL1869009 0.90 ADORA1 (0.47) ADORA1ADORA3ADORA2BDRD2ALPL
SCHEMBL1871234 0.89 ADORA1 (0.47) ADORA1ADORA3ADORA2BDRD2ADORA2A
SCHEMBL1870513 0.89 ADORA1 (0.58) ADORA1ADORA3ADORA2BDRD2
SCHEMBL1871179 0.88 ADORA1 (0.46) ADORA1ADORA3ADORA2BDRD2KDM2B
SCHEMBL1866939 0.88 ADORA1 (0.44) ADORA1ADORA3ADORA2BALPLADORA2A
SCHEMBL1864689 0.87 ADORA1 (0.44) ADORA1ADORA3ADORA2BADORA2A
SCHEMBL1870359 0.87 ADORA1 (0.44) ADORA1ADORA3ADORA2BALPLADORA2A
SCHEMBL1870705 0.86 ADORA1 (0.42) ADORA1ADORA3ADORA2BADORA2A
SCHEMBL1874917 0.86 ADORA1 (0.57) ADORA1ADORA3ADORA2BADORA2A
SCHEMBL1871164 0.85 ADORA1 (0.45) ADORA1ADORA3ADORA2BADORA2A

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-2499142-A1 SUBSTITUTED FUSED PYRIMIDINE COMPOUNDS, ITS PREPARATION AND USES THEREOF Advinus Therapeutics Limited (IN) 2012-09-19 EP claimed
WO-2011055391-A1 SUBSTITUTED FUSED PYRIMIDINE COMPOUNDS, ITS PREPARATION AND USES THEREOF ADVINUS THERAPEUTICS PRIVATE LIMITED (IN) 2011-05-12 WO claimed