SCHEMBL19924035

SCHEMBL19924035

CCC(C)n1c(=O)c2c(C)c(C(=O)O)sc2n(CCOC)c1=O

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADORA2B P29275 20/20 0.60
ADORA2A P29274 1/20 0.48
ADORA1 P30542 1/20 0.48

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
SCHEMBL18097332 0.87 ADORA2B (0.51) ADORA2BADORA2AADORA1
SCHEMBL19923867 0.84 ADORA2B (0.58) ADORA2BADORA2AADORA1
SCHEMBL16637157 0.84 ADORA2B (0.71) ADORA2BADORA2AADORA1
SCHEMBL16637750 0.83 ADORA2B (0.73) ADORA2B
SCHEMBL18097137 0.82 ADORA2B (0.64) ADORA2BADORA2AADORA1
SCHEMBL19924094 0.82 ADORA2B (0.49) ADORA2BADORA2AADORA1
SCHEMBL18097475 0.80 ADORA2B (0.56) ADORA2BADORA2AADORA1
SCHEMBL18096860 0.78 ADORA2B (0.44) ADORA2BADORA2AADORA1
SCHEMBL18097613 0.78 ADORA2B (0.59) ADORA2BADORA2AADORA1
SCHEMBL18097555 0.78 ADORA2B (0.59) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10428083-B2 Heterocyclylmethyl-thienouracile as antagonists of the adenosine-A2B-receptor BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2019-10-01 US disclosed
US-20180065981-A1 HETEROCYCLYLMETHYL-THIENOURACILE AS ANTAGONISTS OF THE ADENOSINE-A2B-RECEPTOR BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-03-08 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 (2 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-20180065981-A1 HETEROCYCLYLMETHYL-THIENOURACILE AS ANTAGONISTS OF THE ADENOSINE-A2B-RECEPTOR ADORA2A, ADORA2B, ADORA3 ADORA2B 2/4885ADORA2A 1/4885ADORA1 5/4885
US-10428083-B2 Heterocyclylmethyl-thienouracile as antagonists of the adenosine-A2B-receptor ADORA2A, ADORA2B, ADORA3 ADORA2B 2/4885ADORA2A 1/4885ADORA1 5/4885

“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.