SCHEMBL8856895

SCHEMBL8856895

O=C(O)c1c(-c2ccc(F)cc2)c2cc(OCc3ccccc3)ccc2n1Cc1cc2c(cc1Cl)OCO2

nearest known ligand 0.71

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 19/20 0.71
EDNRA P25101 18/20 0.71

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
SCHEMBL8540948 0.95 EDNRA (0.72) EDNRBEDNRA
SCHEMBL8590639 0.90 EDNRA (0.64) EDNRBEDNRA
SCHEMBL8856638 0.89 EDNRA (0.78) EDNRBEDNRA
SCHEMBL8856815 0.89 EDNRB (0.74) EDNRBEDNRA
SCHEMBL8856577 0.89 EDNRB (0.64) EDNRBEDNRA
SCHEMBL8856820 0.89 EDNRA (0.66) EDNRBEDNRA
SCHEMBL8643680 0.88 EDNRA (0.78) EDNRBEDNRA
SCHEMBL8856661 0.88 EDNRB (0.60) EDNRBEDNRA
SCHEMBL8856822 0.87 EDNRA (0.70) EDNRBEDNRA
SCHEMBL8856755 0.87 EDNRB (0.65) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5684032-A ANTIINFLAMMATORY AGENTS, ANTIARTHRITIC, ANTIASTHMATIC AGENTS AND RESPIRATORY DISORDERS SMITHKLINE BEECHAM CORPORATION (US) 1997-11-04 US claimed
US-5684032-A ANTIINFLAMMATORY AGENTS, ANTIARTHRITIC, ANTIASTHMATIC AGENTS AND RESPIRATORY DISORDERS SMITHKLINE BEECHAM CORPORATION (US) 1997-11-04 US disclosed