Imidazole

Imidazole

SCHEMBL9050394

COc1cc(OC)nc(SC(C(=O)O)C(C)(OC)C(F)(F)F)n1.c1c[nH]cn1

nearest known ligand 0.35

Full drug profile on Sugi Atlas →

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 9/20 0.33
EDNRA P25101 9/20 0.33

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
SCHEMBL9050654 0.89 EDNRB (0.39) EDNRBEDNRA
SCHEMBL9054345 0.78 EDNRB (0.42) EDNRBEDNRA
SCHEMBL9051577 0.77 EDNRB (0.40) EDNRBEDNRA
SCHEMBL9051237 0.77 ALDH1A1 (0.33) EDNRBEDNRA
SCHEMBL9052951 0.76 EDNRB (0.39) EDNRBEDNRA
SCHEMBL9051600 0.76 EDNRB (0.40) EDNRBEDNRA
SCHEMBL9050413 0.75 CYP24A1 (0.31)
SCHEMBL9588704 0.74 EDNRB (0.41) EDNRBEDNRA
SCHEMBL8943529 0.69 EDNRB (0.37) EDNRBEDNRA
SCHEMBL8098308 0.68 EDNRB (0.50) 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
WO-1996000219-A1 PYRIMIDINYL- AND TRIAZINYL-OXY AND THIO-3-HALOALKYL-PROPIONIC ACID DERIVATIVES AS HERBICIDES CIBA-GEIGY AG (CH) 1996-01-04 WO disclosed