SCHEMBL9068751

SCHEMBL9068751

O=C(N[C@@H](Cc1ccc(O)c(O)c1)C(=O)O)C(CS)Cc1ccccc1

nearest known ligand 0.78

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MME P08473 4/20 0.77
HRH4 Q9H3N8 1/20 0.61

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
SCHEMBL6173142 0.88 MME (0.86) MMEHRH4
SCHEMBL6173139 0.88 MME (0.86) MMEHRH4
SCHEMBL6170941 0.87 MME (1.00) MMEHRH4
SCHEMBL6170943 0.87 MME (1.00) MMEHRH4
SCHEMBL6168678 0.86 MME (0.82) MMEHRH4
SCHEMBL6171524 0.86 MME (0.82) MMEHRH4
SCHEMBL11438800 0.84 MME (0.79) MMEHRH4
SCHEMBL9068532 0.83 MME (0.54) MME
SCHEMBL929211 0.83 MME (0.83) MME
SCHEMBL929063 0.83 MME (0.83) MME

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
US-5496805-A DIURETIC, HYPOTENSIVE E. R. SQUIBB & SONS, INC. (US) 1996-03-05 US disclosed