SCHEMBL6221749

SCHEMBL6221749

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

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LHCGR P22888 18/20 0.67
FSHR P23945 5/20 0.67
TSHR P16473 2/20 0.62

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
SCHEMBL6222712 0.89 LHCGR (0.69) LHCGRFSHRTSHR
SCHEMBL6221420 0.87 LHCGR (0.69) LHCGRFSHRTSHR
SCHEMBL6222004 0.87 LHCGR (0.68) LHCGRFSHRTSHR
SCHEMBL14285229 0.86 LHCGR (0.73) LHCGRFSHRTSHR
SCHEMBL5028843 0.85 LHCGR (0.72) LHCGRFSHRTSHR
SCHEMBL5028842 0.83 LHCGR (0.67) LHCGRFSHRTSHR
SCHEMBL5028832 0.83 LHCGR (0.67) LHCGRFSHRTSHR
SCHEMBL30673520 0.83 LHCGR (0.67) LHCGRFSHRTSHR
SCHEMBL30673524 0.83 LHCGR (0.67) LHCGRFSHRTSHR
SCHEMBL6222639 0.83 LHCGR (0.65) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed