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SCHEMBL8860728

SCHEMBL8860728

CCCCS(=O)(=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(-c2ccno2)cc1)N(C)C(=O)c1cc(C)cc(C)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ EDNRB P24530 20/20 1.00
▸ EDNRA P25101 20/20 1.00

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
SCHEMBL10013433 0.91 EDNRB (1.00) EDNRBEDNRA
SCHEMBL8860879 0.90 EDNRB (1.00) EDNRBEDNRA
SCHEMBL7451079 0.85 EDNRB (1.00) EDNRBEDNRA
SCHEMBL7444230 0.80 EDNRB (0.90) EDNRBEDNRA
SCHEMBL7433861 0.79 EDNRB (0.66) EDNRBEDNRA
SCHEMBL7446711 0.78 EDNRB (0.90) EDNRBEDNRA
SCHEMBL13065887 0.78 EDNRB (0.75) EDNRBEDNRA
SCHEMBL7445789 0.77 EDNRB (0.65) EDNRBEDNRA
SCHEMBL7450205 0.77 EDNRB (0.85) EDNRBEDNRA
SCHEMBL7359820 0.77 EDNRB (0.74) EDNRBEDNRA

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-5703106-A TREATING VARIOUS CARDIOVASCULAR, UROGENITAL, BRAIN DISORDERS JAPAT LTD. (CH) 1997-12-30 — — US disclosed