SCHEMBL8534495

SCHEMBL8534495

CCOC(C)(C)C(Oc1nc(OC)cc(OC)n1)C(=O)O

nearest known ligand 0.68

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 20/20 0.68
EDNRA P25101 20/20 0.68

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
SCHEMBL9558022 0.88 EDNRB (0.57) EDNRBEDNRA
SCHEMBL9590496 0.87 EDNRB (0.56) EDNRBEDNRA
SCHEMBL9119578 0.86 EDNRB (0.65) EDNRBEDNRA
SCHEMBL8943528 0.86 EDNRB (0.50) EDNRBEDNRA
SCHEMBL9050809 0.85 EDNRB (0.63) EDNRBEDNRA
SCHEMBL9367683 0.83 EDNRB (0.66) EDNRBEDNRA
SCHEMBL8535045 0.82 EDNRB (0.51) EDNRBEDNRA
SCHEMBL9372708 0.81 EDNRB (0.64) EDNRBEDNRA
SCHEMBL7071036 0.81 EDNRB (1.00) EDNRBEDNRA
SCHEMBL9373008 0.81 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0517215-B1 Pyrimidine or triazine derivative, process for preparing the same and herbicide using the same UBE INDUSTRIES (JP) 1998-09-02 EP disclosed
US-5529977-A A 3-ALKOXYBUTYRYLIMIDAZOLE COMPOUND UBE INDUSTRIES, LTD. (JP) 1996-06-25 US disclosed
US-5387575-A Pyrimidine derivatives, process for preparing the same and herbicide using the same UBE INDUSTRIES, LTD. (JP) 1995-02-07 US disclosed
US-5178663-A Pyrimidinyloxy or pyrimidinylthio compounds UBE INDUSTRIES, LTD. (JP) 1993-01-12 US disclosed
EP-0517215-A1 Pyrimidine or triazine derivative, process for preparing the same and herbicide using the same UBE INDUSTRIES, LTD. (JP) 1992-12-09 EP disclosed
EP-0481512-A1 3-Alkoxyalkanoic acid derivative, process for preparing the same and herbicide using the same UBE INDUSTRIES, LTD. (JP) 1992-04-22 EP disclosed