SCHEMBL5028902

SCHEMBL5028902

CSc1nc(-c2cccc(NC(=O)CN3CCSCC3)c2)c2c(N)c(C(N)=O)sc2n1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BRAF P15056 12/20 0.52
LHCGR P22888 7/20 0.50
FSHR P23945 2/20 0.50
TSHR P16473 1/20 0.48
PDE4A P27815 3/20 0.44
PDE4B Q07343 3/20 0.44
PDE4C Q08493 3/20 0.44
PDE4D Q08499 3/20 0.44

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
SCHEMBL5026102 0.94 LHCGR (0.53) BRAFLHCGRFSHRTSHRPDE4A
SCHEMBL5030680 0.94 LHCGR (0.53) BRAFLHCGRFSHRTSHRPDE4A
SCHEMBL5024538 0.93 LHCGR (0.52) BRAFLHCGRFSHRTSHRPDE4A
SCHEMBL5765184 0.91 BRAF (0.51) BRAFLHCGRFSHRTSHRPDE4A
SCHEMBL5030719 0.91 BRAF (0.51) BRAFLHCGRFSHRTSHR
SCHEMBL5026093 0.90 LHCGR (0.64) BRAFLHCGRFSHRTSHR
SCHEMBL30673522 0.90 LHCGR (0.64) BRAFLHCGRFSHRTSHR
SCHEMBL5024555 0.85 LHCGR (0.55) BRAFLHCGRFSHRTSHRPDE4A
SCHEMBL4432274 0.85 LHCGR (0.48) BRAFLHCGRFSHRTSHRPDE4A
SCHEMBL5028832 0.84 LHCGR (0.67) LHCGRFSHRTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1427733-B1 THIENO[2,3-D]PYRIMIDINES WITH COMBINED LH AND FSH AGONISTIC ACTIVITY ORGANON NV (NL) 2006-11-15 EP claimed
WO-2023239854-A2 METHOD OF TREATING OBESITY WITH A LUTEINIZING HORMONE RECEPTOR AGONIST ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) 2023-12-14 WO disclosed
US-7317006-B2 Thieno[2,3-d]pyrimidines with combined LH and FSH agonistic activity N.V. ORGANON (NL) 2008-01-08 US disclosed
EP-1427733-B1 THIENO[2,3-D]PYRIMIDINES WITH COMBINED LH AND FSH AGONISTIC ACTIVITY ORGANON NV (NL) 2006-11-15 EP disclosed
US-20040180873-A1 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-20040180873-A1 Thieno{2,3-d}pyrimidines with combined lh and fsh agonistic activity FSHR, GNRHR, LHCGR BRAF 4516/4885LHCGR 3/4885FSHR 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.