SCHEMBL6508037

SCHEMBL6508037

COc1cc(-c2cc3c([nH]2)c(=O)n(C)c(=O)n3C)ccc1OCC(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADORA2B P29275 20/20 1.00
ADORA2A P29274 18/20 0.79
ADORA1 P30542 1/20 0.55

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
SCHEMBL6506235 0.84 ADORA2B (1.00) ADORA2BADORA2AADORA1
SCHEMBL6505398 0.83 ADORA2B (1.00) ADORA2BADORA2AADORA1
SCHEMBL6689722 0.83 ADORA2B (1.00) ADORA2BADORA2AADORA1
SCHEMBL6509445 0.82 ADORA2B (1.00) ADORA2BADORA2AADORA1
SCHEMBL6508389 0.81 ADORA2B (1.00) ADORA2BADORA2AADORA1
SCHEMBL6528086 0.81 ADORA2B (1.00) ADORA2BADORA2AADORA1
SCHEMBL6534038 0.81 ADORA2B (0.86) ADORA2BADORA2AADORA1
SCHEMBL6508109 0.80 ADORA2B (1.00) ADORA2BADORA2AADORA1
SCHEMBL6506298 0.80 ADORA2B (0.78) ADORA2BADORA2AADORA1
SCHEMBL6507101 0.79 ADORA2B (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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005090309-A1 1,2-DIHYDROQUINOLINE DERIVATIVES AND METHOD FOR USING THE SAME TO TREAT HIV INFECTION WYETH (US) 2005-09-29 WO disclosed
US-20050070558-A1 6-Phenyldihydropyrrolopyrimidinedione derivatives ALMIRALL PRODESFARMA S.A. (ES) 2005-03-31 US disclosed
EP-0742810-A1 RUBBER COMPOUNDING FORMULATION AND METHOD UNIROYAL CHEMICAL COMPANY, Inc. (US) 1996-11-20 EP disclosed
WO-1995021214-A1 RUBBER COMPOUNDING FORMULATION AND METHOD UNIROYAL CHEMICAL COMPANY, INC. (US) 1995-08-10 WO 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.