SCHEMBL6873459

SCHEMBL6873459

COCCN(C)c1ccc(OC)c2nc(NC(=O)c3ccnc(C)c3)sc12

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ADORA2B P29275 18/20 0.56
▸ ADORA2A P29274 16/20 0.56
▸ ADORA1 P30542 16/20 0.56
▸ CHRM4 P08173 1/20 0.52

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
SCHEMBL6868235 0.90 ADORA2B (0.56) ADORA2BADORA2AADORA1CHRM4
SCHEMBL6873671 0.87 ADORA2B (0.50) ADORA2BADORA2AADORA1CHRM4
SCHEMBL6875267 0.86 DUSP3 (0.54) ADORA2BADORA2AADORA1CHRM4
SCHEMBL6868703 0.86 ADORA2B (0.57) ADORA2BADORA2AADORA1CHRM4
SCHEMBL5713556 0.85 ADORA2B (0.65) ADORA2BADORA2AADORA1
SCHEMBL6877728 0.84 ADORA2B (0.72) ADORA2BADORA2AADORA1
SCHEMBL6868256 0.84 ADORA2A (0.55) ADORA2BADORA2AADORA1
SCHEMBL6876108 0.83 ADORA2B (0.79) ADORA2BADORA2AADORA1
SCHEMBL6872814 0.81 ADORA2B (0.63) ADORA2BADORA2AADORA1
Hydrochloric Acid SCHEMBL6876107 0.80 ADORA2B (0.61) 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
EP-1456188-A1 7-AMINO-BENZOTHIAZOLE DERIVATIVES AS ADENOSINE RECEPTOR LIGANDS F. HOFFMANN-LA ROCHE AG (CH) 2004-09-15 — — EP disclosed
US-6713499-B2 ADENOSINE RECEPTOR AGONIST HOFFMAN-LA ROCHE INC. 2004-03-30 — — US disclosed
US-20030153566-A1 7-Amino-benzothiazole derivatives F. HOFFMANN-LA ROCHE AG (CH) 2003-08-14 — — US disclosed
WO-2003053946-A1 7-AMINO-BENZOTHIAZOLE DERIVATIVES AS ADENOSINE RECEPTOR LIGANDS F. HOFFMANN-LA ROCHE AG (CH) 2003-07-03 — — 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-20030153566-A1 7-Amino-benzothiazole derivatives ADORA1, ADORA2A, ADORA3 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.

Send feedback