SCHEMBL6505264

SCHEMBL6505264

CCCn1c(=O)[nH]c2cc(-c3ccc(OCC(=O)O)cc3)[nH]c2c1=O

nearest known ligand 0.71

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADORA2B P29275 19/20 0.71
ADORA2A P29274 13/20 0.71
ADORA1 P30542 4/20 0.70
ADORA3 P0DMS8 3/20 0.68

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
SCHEMBL6529743 0.85 ADORA2B (0.73) ADORA2BADORA2AADORA1ADORA3
SCHEMBL6509430 0.85 ADORA2B (0.63) ADORA2BADORA2AADORA1ADORA3
SCHEMBL6510944 0.84 ADORA2B (0.61) ADORA2BADORA2AADORA1ADORA3
SCHEMBL6510136 0.83 ADORA2B (1.00) ADORA2BADORA2AADORA1ADORA3
SCHEMBL6531721 0.83 ADORA2B (1.00) ADORA2BADORA2AADORA1ADORA3
SCHEMBL6506951 0.83 ADORA2B (1.00) ADORA2BADORA2AADORA1ADORA3
SCHEMBL6504458 0.83 ADORA2B (0.76) ADORA2BADORA2A
SCHEMBL6509393 0.82 ADORA2B (0.78) ADORA2BADORA2AADORA1ADORA3
SCHEMBL24227597 0.82 ADORA2B (1.00) ADORA2BADORA2AADORA1ADORA3
SCHEMBL6503867 0.80 ADORA2A (1.00) 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 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 2/4885ADORA1 1/4885

“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.