SCHEMBL21769004

SCHEMBL21769004

Cc1nc2nc(Cl)nc(C(=O)N3CC[C@H](O)C3)c2s1

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADORA2B P29275 15/20 0.40
ADORA2A P29274 6/20 0.40
ADORA3 P0DMS8 1/20 0.37

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
SCHEMBL21769007 1.00 ADORA2B (0.40) ADORA2BADORA2AADORA3
SCHEMBL21769044 0.82 POLB (0.43) ADORA2BADORA2AADORA3
SCHEMBL21768831 0.82 POLB (0.40) ADORA2BADORA2AADORA3
SCHEMBL20785200 0.79 ADORA2B (0.58) ADORA2BADORA2AADORA3
SCHEMBL20784422 0.79 ADORA2B (0.58) ADORA2BADORA2AADORA3
SCHEMBL20785503 0.73 ADORA2B (0.58) ADORA2BADORA2AADORA3
SCHEMBL21769012 0.72 ALDH1A1 (0.37)
Hydrochloric Acid SCHEMBL21768908 0.70 ALDH1A1 (0.36)
SCHEMBL17778071 0.67 IRAK4 (0.39) ADORA2BADORA2A
SCHEMBL17778065 0.67 IRAK4 (0.39) ADORA2BADORA2A

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
US-20200079793-A1 COMPOUNDS AND METHODS FOR MODULATING ADENOSINE A2B RECEPTOR AND ADENOSINE A2A RECEPTOR CORVUS PHARMACEUTICALS, INC. 2020-03-12 US disclosed
EP-3616753-A1 COMPOUNDS FOR MODULATING ADENOSINE A2B RECEPTOR AND ADENOSINE A2A RECEPTOR Corvus Pharmaceuticals, Inc. (US) 2020-03-04 EP disclosed
EP-3616753-A1 COMPOUNDS FOR MODULATING ADENOSINE A2B RECEPTOR AND ADENOSINE A2A RECEPTOR Corvus Pharmaceuticals, Inc. (US) 2020-03-04 EP 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-20200079793-A1 COMPOUNDS AND METHODS FOR MODULATING ADENOSINE A2B RECEPTOR AND ADENOSINE A2A RECEPTOR ADORA2A, ADORA2B, ADORA3 ADORA2B 2/4885ADORA2A 1/4885ADORA3 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.