SCHEMBL6504458

SCHEMBL6504458

CCCn1c(=O)[nH]c(=O)c2[nH]c(-c3ccc(OCC(=O)O)cc3)cc21

nearest known ligand 0.76

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ADORA2B P29275 20/20 0.76
ADORA2A P29274 14/20 0.74

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
SCHEMBL6506951 0.85 ADORA2B (1.00) ADORA2BADORA2A
SCHEMBL6503867 0.84 ADORA2A (1.00) ADORA2BADORA2A
SCHEMBL6509058 0.83 ADORA2B (1.00) ADORA2BADORA2A
SCHEMBL6505264 0.83 ADORA2B (0.71) ADORA2BADORA2A
SCHEMBL24227597 0.82 ADORA2B (1.00) ADORA2BADORA2A
SCHEMBL5741227 0.81 ADORA2B (0.68) ADORA2BADORA2A
SCHEMBL6512294 0.80 ADORA2B (0.79) ADORA2BADORA2A
SCHEMBL6511660 0.78 ADORA2B (0.80) ADORA2BADORA2A
SCHEMBL6506235 0.76 ADORA2B (1.00) ADORA2BADORA2A
SCHEMBL6505455 0.75 ADORA2B (0.81) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050070558-A1 6-Phenyldihydropyrrolopyrimidinedione derivatives ALMIRALL PRODESFARMA S.A. (ES) 2005-03-31 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-20050070558-A1 6-Phenyldihydropyrrolopyrimidinedione derivatives ADORA1, ADORA2A, P2RY10 ADORA2B 4/4885ADORA2A 2/4885

“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.