SCHEMBL7222995

SCHEMBL7222995

Cn1nc(OCCOc2ncc(Br)cn2)c(-c2ccc(OC(F)(F)F)cc2)c1NS(=O)(=O)c1ccccc1C(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 8/20 0.42
EDNRA P25101 7/20 0.40

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
SCHEMBL6289735 0.87 EDNRB (0.57) EDNRBEDNRA
SCHEMBL6289228 0.79 EDNRB (0.60) EDNRBEDNRA
SCHEMBL6289619 0.78 EDNRB (0.59) EDNRBEDNRA
SCHEMBL7222998 0.78 EDNRB (0.41) EDNRBEDNRA
SCHEMBL6289866 0.78 EDNRB (0.59) EDNRBEDNRA
SCHEMBL6292768 0.77 EDNRB (0.60) EDNRBEDNRA
SCHEMBL7222996 0.76 EDNRB (0.38) EDNRBEDNRA
SCHEMBL6292812 0.76 EDNRB (0.70) EDNRBEDNRA
SCHEMBL6289639 0.76 EDNRB (0.45) EDNRBEDNRA
SCHEMBL6289656 0.76 EDNRB (0.60) 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-6573270-B1 Endothelin receptor antagonists PFIZER INC. 2003-06-03 US disclosed