SCHEMBL1869389

SCHEMBL1869389

CCCn1c(Oc2ccc3cccc(Cl)c3n2)nc(=O)c2c1N=C(C1CCCC1)[N]2

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 12/20 0.36
ADORA3 P0DMS8 2/20 0.35
ADORA2A P29274 1/20 0.33
ADORA2B P29275 1/20 0.33
XPO1 O14980 1/20 0.31

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
SCHEMBL1875998 0.87 ADORA1 (0.38) ADORA1ADORA3ADORA2AADORA2B
SCHEMBL1869240 0.84 ADORA1 (0.38) ADORA1ADORA3ADORA2AADORA2B
SCHEMBL1871730 0.81 ADORA1 (0.40) ADORA1ADORA3ADORA2AADORA2B
SCHEMBL1864786 0.81 ADORA1 (0.39) ADORA1ADORA3ADORA2AADORA2B
SCHEMBL1867846 0.79 ADORA1 (0.41) ADORA1ADORA3ADORA2AADORA2B
SCHEMBL1868269 0.78 ADORA1 (0.59) ADORA1ADORA3ADORA2AADORA2B
SCHEMBL1871420 0.78 ADORA1 (0.41) ADORA1ADORA3ADORA2AADORA2B
SCHEMBL1875007 0.78 ADORA1 (0.55) ADORA1ADORA3ADORA2AADORA2B
SCHEMBL1866236 0.78 ADORA1 (0.41) ADORA1ADORA3ADORA2AADORA2B
SCHEMBL1868066 0.77 ADORA1 (0.38) ADORA1ADORA3ADORA2AADORA2B

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