SCHEMBL14201625

SCHEMBL14201625

Nc1ncnc2c1nnn2CCCO

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 9/20 0.57
▸ ADORA1 P30542 6/20 0.54
▸ ADORA2B P29275 4/20 0.54
▸ ADORA3 P0DMS8 2/20 0.54
▸ PDE8B O95263 1/20 0.47
▸ ADCY1 Q08828 1/20 0.45
▸ AHCY P23526 4/20 0.44
▸ CSNK2A2 P19784 1/20 0.43
▸ CSNK2B P67870 1/20 0.43
▸ CSNK2A1 P68400 1/20 0.43
▸ CSNK2A3 Q8NEV1 1/20 0.43
▸ PKM P14618 1/20 0.41
▸ NEK2 P51955 1/20 0.41
▸ PLK1 P53350 1/20 0.41
▸ GSK3B P49841 1/20 0.39
▸ HSP90AA1 P07900 1/20 0.39
▸ HSP90AB1 P08238 1/20 0.39

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
SCHEMBL7104678 0.83 ADORA2A (0.52) ADORA2AADORA1ADORA2BPDE8B
SCHEMBL21504439 0.78 PDE8B (0.52) ADORA2AADORA1ADORA2BADORA3PDE8B
SCHEMBL21759036 0.77 PDE8B (0.46) ADORA2AADORA1ADORA2BADORA3PDE8B
SCHEMBL13851102 0.77 ADORA2A (0.53) ADORA2AADORA1ADORA2BADORA3PDE8B
SCHEMBL14201624 0.76 PDE8B (0.44) ADORA2APDE8B
SCHEMBL8357822 0.76 ADORA2A (0.59) ADORA2AADORA1ADORA2BPDE8BAHCY
SCHEMBL8357826 0.76 ADORA2A (0.59) ADORA2AADORA1ADORA2BPDE8BAHCY
SCHEMBL4315191 0.76 PDE8B (0.46) ADORA2APDE8B
SCHEMBL24236965 0.73 PDE8B (0.48) ADORA2AADORA1ADORA2BADORA3PDE8B
SCHEMBL1635576 0.73 ADORA2A (1.00) ADORA2AADORA1ADORA2BADCY1AHCY

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-20080096903-A1 SULFAMOYL-CONTAINING DERIVATIVES AND USES THEREOF WYETH (US) 2008-04-24 — — US disclosed
US-20080096903-A1 SULFAMOYL-CONTAINING DERIVATIVES AND USES THEREOF WYETH (US) 2008-04-24 — — 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-20080096903-A1 SULFAMOYL-CONTAINING DERIVATIVES AND USES THEREOF HSP90AB2P, HSP90AB1, HSP90AA1 ADORA2A 4635/4885ADORA1 4822/4885ADORA2B 4770/4885

“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.

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