SCHEMBL5030909

SCHEMBL5030909

NC(=O)c1sc2nc(-c3ccncc3)nc(-c3cccc(N)c3)c2c1N

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BRAF P15056 16/20 0.61
PDE4A P27815 9/20 0.61
PDE4B Q07343 9/20 0.61
PDE4C Q08493 9/20 0.61
PDE4D Q08499 9/20 0.61
IKBKB O14920 1/20 0.47
PRKCI P41743 1/20 0.45
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.45
MAPT P10636 1/20 0.45
HTT P42858 1/20 0.45
LIMK1 P53667 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
CDC7 O00311 1/20 0.43
DBF4 Q9UBU7 1/20 0.43

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
SCHEMBL4419064 0.92 BRAF (0.64) BRAFPDE4APDE4BPDE4CPDE4D
SCHEMBL5026167 0.91 BRAF (0.51) BRAFPDE4APDE4BPDE4CPDE4D
SCHEMBL5026126 0.85 BRAF (0.59) BRAFPDE4APDE4BPDE4CPDE4D
SCHEMBL5026177 0.85 KDM4E (0.54) BRAFPDE4APDE4BPDE4CPDE4D
SCHEMBL5024674 0.85 LHCGR (0.59) BRAFPDE4APDE4BPDE4CPDE4D
SCHEMBL4427626 0.84 BRAF (0.54) BRAFPDE4APDE4BPDE4CPDE4D
SCHEMBL5026948 0.83 BRAF (0.52) BRAFPDE4APDE4BPDE4CPDE4D
SCHEMBL5026165 0.82 LIMK1 (0.60) BRAFPDE4APDE4BPDE4CPDE4D
SCHEMBL27491238 0.81 MAPT (0.56) IKBKBPRKCIKDM4EALDH1A1MAPT
SCHEMBL4421145 0.79 BRAF (0.62) 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.