SCHEMBL5030898

SCHEMBL5030898

C=CCNc1nc(-c2cccc(NC(=O)CNCC(=O)OC)c2)c2c(N)c(C(N)=O)sc2n1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BRAF P15056 20/20 0.53
PDE4A P27815 9/20 0.49
PDE4B Q07343 9/20 0.49
PDE4C Q08493 9/20 0.49
PDE4D Q08499 9/20 0.49

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
SCHEMBL5028890 0.91 BRAF (0.58) BRAFPDE4APDE4BPDE4CPDE4D
SCHEMBL6221309 0.91 LHCGR (0.52) BRAFPDE4APDE4BPDE4CPDE4D
SCHEMBL5030974 0.83 LHCGR (0.53) BRAFPDE4APDE4BPDE4CPDE4D
SCHEMBL5024665 0.82 BRAF (0.49) BRAFPDE4APDE4BPDE4CPDE4D
SCHEMBL6225588 0.81 LHCGR (0.55) BRAFPDE4APDE4BPDE4CPDE4D
SCHEMBL5028885 0.81 BRAF (0.48) BRAFPDE4APDE4BPDE4CPDE4D
SCHEMBL5026981 0.75 BRAF (0.55) BRAFPDE4APDE4BPDE4CPDE4D
SCHEMBL6220667 0.75 LHCGR (0.53) BRAF
SCHEMBL6221420 0.74 LHCGR (0.69)
SCHEMBL1176072 0.73 BRAF (0.46) BRAFPDE4APDE4BPDE4CPDE4D

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7375109-B2 Glycine-substituted thieno[2,3-d]pyrimidines with combined LH and FSH agonistic activity N.V. ORGANON (NL) 2008-05-20 US disclosed
EP-1427734-B1 GLYCINE-SUBSTITUTED THIENO[2,3-d]PYRIMIDINES WITH COMBINED LH AND FSH AGONISTIC ACTIVITY AKZO NOBEL NV (NL) 2005-11-09 EP disclosed
US-20040180907-A1 Glycine-substituted thieno{2,3-d}pyrimidines with combined lh and fsh agonistic activity MERCK SHARP & DOHME B.V. (NL) 2004-09-16 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-20040180907-A1 Glycine-substituted thieno{2,3-d}pyrimidines with combined lh and fsh agonistic activity FSHR, GNRHR, LHCGR BRAF 4677/4885PDE4A 638/4885PDE4B 915/4885

“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.