SCHEMBL5043509

SCHEMBL5043509

COCCN(CCOC)CCS(=O)(=O)Nc1cccc(-c2nc(SC)nc3sc(C(=O)NC(C)(C)C)c(N)c23)c1

nearest known ligand 0.65

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LHCGR P22888 18/20 0.65
TSHR P16473 2/20 0.65
FSHR P23945 5/20 0.60

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
SCHEMBL4427689 0.91 LHCGR (0.52) LHCGRTSHRFSHR
SCHEMBL6225680 0.87 LHCGR (0.67) LHCGRTSHRFSHR
SCHEMBL5026105 0.85 LHCGR (0.65) LHCGRTSHRFSHR
SCHEMBL5037173 0.84 LHCGR (0.62) LHCGRTSHRFSHR
SCHEMBL5034058 0.84 LHCGR (0.63) LHCGRTSHRFSHR
SCHEMBL5036592 0.83 LHCGR (0.61) LHCGRTSHRFSHR
SCHEMBL4429147 0.82 LHCGR (0.70) LHCGRTSHRFSHR
SCHEMBL4425902 0.82 LHCGR (0.78) LHCGRTSHRFSHR
SCHEMBL5028843 0.80 LHCGR (0.72) LHCGRTSHRFSHR
SCHEMBL4326072 0.80 LHCGR (1.00) LHCGRTSHRFSHR

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-1886999-A2 Bicyclic heteroaromatic compound N.V. Organon (NL) 2008-02-13 EP disclosed