SCHEMBL1066263

SCHEMBL1066263

CCCn1c(=O)c2[nH]c(-c3cnn(CC4CC(=O)N(Cc5cccc(C(F)(F)F)c5)C4)c3)nc2n(CCC)c1=O

nearest known ligand 0.78

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADORA2B P29275 20/20 0.78
ADORA2A P29274 9/20 0.76
ADORA1 P30542 9/20 0.76
ADORA3 P0DMS8 6/20 0.76
PLK4 O00444 1/20 0.73
CDK2 P24941 1/20 0.73
IRAK1 P51617 1/20 0.73
RPS6KA3 P51812 1/20 0.73
PLK3 Q9H4B4 1/20 0.73
CSNK1G3 Q9Y6M4 1/20 0.73

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
SCHEMBL4399634 0.98 ADORA2B (0.78) ADORA2BADORA2AADORA1ADORA3PLK4
SCHEMBL1060893 0.91 ADORA2B (0.77) ADORA2BADORA2AADORA1ADORA3
SCHEMBL4406403 0.90 ADORA2B (0.80) ADORA2BADORA2AADORA1ADORA3PLK4
SCHEMBL1067171 0.88 ADORA2B (0.78) ADORA2BADORA2AADORA1ADORA3PLK4
SCHEMBL1064677 0.87 ADORA2B (1.00) ADORA2BADORA2AADORA1
SCHEMBL242517 0.87 ADORA2B (1.00) ADORA2BADORA2AADORA1ADORA3PLK4
SCHEMBL1059556 0.86 ADORA2B (0.78) ADORA2BADORA2AADORA1
SCHEMBL1061290 0.86 ADORA2B (0.75) ADORA2BADORA2AADORA1ADORA3
SCHEMBL4404242 0.85 ADORA2B (1.00) ADORA2BADORA2AADORA1
SCHEMBL1083460 0.85 ADORA2B (0.78) ADORA2BADORA2AADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2268641-B1 HETEROCYCLIC COMPOUNDS AS ADENOSINE RECEPTOR ANTAGONIST ADVINUS THERAPEUTICS PVT LTD (IN) 2014-09-03 EP claimed
US-8252797-B2 Heterocyclic compounds as adenosine receptor antagonist ADVINUS THERAPEUTICS PVT. LTD. (IN) 2012-08-28 US claimed
EP-2268641-A2 HETEROCYCLIC COMPOUNDS AS ADENOSINE RECEPTOR ANTAGONIST Advinus Therapeutics Pvt. Ltd. (IN) 2011-01-05 EP claimed
US-20090298744-A1 HETEROCYCLIC COMPOUNDS AS ADENOSINE RECEPTOR ANTAGONIST ADVINUS THERAPEUTICS PVT. LTD. (IN) 2009-12-03 US claimed
WO-2009118759-A2 HETEROCYCLIC COMPOUNDS AS ADENOSINE RECEPTOR ANTAGONIST ADVINUS THERAPEUTICS PVT. LTD., (IN) 2009-10-01 WO claimed
EP-2268641-B1 HETEROCYCLIC COMPOUNDS AS ADENOSINE RECEPTOR ANTAGONIST ADVINUS THERAPEUTICS PVT LTD (IN) 2014-09-03 EP disclosed
US-8252797-B2 Heterocyclic compounds as adenosine receptor antagonist ADVINUS THERAPEUTICS PVT. LTD. (IN) 2012-08-28 US disclosed
US-20090298744-A1 HETEROCYCLIC COMPOUNDS AS ADENOSINE RECEPTOR ANTAGONIST ADVINUS THERAPEUTICS PVT. LTD. (IN) 2009-12-03 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090298744-A1 HETEROCYCLIC COMPOUNDS AS ADENOSINE RECEPTOR ANTAGONIST ADORA2A, ADORA3, ADORA1 ADORA2B 4/4885ADORA2A 1/4885ADORA1 3/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.