SCHEMBL8915088

SCHEMBL8915088

CCc1ccc(Cc2sc3ccccc3c2S(=O)(=O)Nc2onc(C)c2Br)cc1.Cc1noc(NS(=O)(=O)c2c(Cc3ccc4c(c3)OCO4)sc3ccccc23)c1Br

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 20/20 0.55
EDNRA P25101 20/20 0.55

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
SCHEMBL4630675 0.96 EDNRB (0.58) EDNRBEDNRA
SCHEMBL6151498 0.90 EDNRA (0.53) EDNRBEDNRA
SCHEMBL7212878 0.88 EDNRA (0.53) EDNRBEDNRA
SCHEMBL6150865 0.86 EDNRA (0.54) EDNRBEDNRA
SCHEMBL6151088 0.84 EDNRA (0.58) EDNRBEDNRA
SCHEMBL6151587 0.81 EDNRA (0.55) EDNRBEDNRA
SCHEMBL7346056 0.81 EDNRA (0.50) EDNRBEDNRA
SCHEMBL6151436 0.81 EDNRA (0.50) EDNRBEDNRA
SCHEMBL6151625 0.80 EDNRA (0.56) EDNRBEDNRA
SCHEMBL4630726 0.79 EDNRA (0.47) 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-5594021-A VASOCONSTRICTORS TEXAS BIOTECHNOLOGY CORPORATION (US) 1997-01-14 US claimed