SCHEMBL8660604

SCHEMBL8660604

CSc1cnc(OCCOc2ncnc(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)c2-c2ccccc2C(=O)O)nc1

nearest known ligand 0.70

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 2/20 0.57
EDNRA P25101 1/20 0.51

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
SCHEMBL8802155 0.86 EDNRB (0.66) EDNRBEDNRA
SCHEMBL7481169 0.83 EDNRB (0.68) EDNRBEDNRA
SCHEMBL8801730 0.83 EDNRB (0.81) EDNRBEDNRA
SCHEMBL7480255 0.82 EDNRB (0.63) EDNRBEDNRA
SCHEMBL8662783 0.82 EDNRB (0.67) EDNRBEDNRA
SCHEMBL7489110 0.82 EDNRB (0.58) EDNRBEDNRA
SCHEMBL7477422 0.82 EDNRB (0.58) EDNRBEDNRA
SCHEMBL8801001 0.82 EDNRB (0.71) EDNRBEDNRA
SCHEMBL8657549 0.82 EDNRB (0.80) EDNRBEDNRA
SCHEMBL8800629 0.82 EDNRB (0.56) 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-5728706-A ENDOTHELIN ANTAGONISTS TANABE SEIYAKU CO., LTD. (JP) 1998-03-17 US disclosed