SCHEMBL9459403

SCHEMBL9459403

COC(=O)C(Oc1nc(OC)cc(OC)n1)C(C)(C)F

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 18/20 0.53
EDNRA P25101 18/20 0.53
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL7811183 0.88 EDNRB (0.55) EDNRBEDNRA
SCHEMBL9059035 0.87 EDNRB (0.50) EDNRBEDNRAL3MBTL1
SCHEMBL9459188 0.87 EDNRB (0.63) EDNRBEDNRA
SCHEMBL9059020 0.82 EDNRB (0.46) EDNRBEDNRA
SCHEMBL6781616 0.80 EDNRB (0.65) EDNRBEDNRA
SCHEMBL8635507 0.79 EDNRB (0.49) EDNRBEDNRA
SCHEMBL8703985 0.78 EDNRB (0.62) EDNRBEDNRA
SCHEMBL9369928 0.77 EDNRB (0.46) EDNRBEDNRA
SCHEMBL9051518 0.77 EDNRB (0.61) EDNRBEDNRA
SCHEMBL9367683 0.77 EDNRB (0.66) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5270289-A Herbicidal dimethoxy pyrimidinyloxy-fluorinated acids and salts SCHERING AKTIENGESELLSCHAFT (DE) 1993-12-14 US disclosed
EP-0409368-B1 SUBSTITUTED ALFA PYRIMIDINYLOXY CARBOXYLIC ACID DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS AN AGENT WITH HERBICIDAL, FUNGICIDAL AND PLANTGROWTH REGULATING ACTIVITY SCHERING AKTIENGESELLSCHAFT (DE) 1992-11-11 EP disclosed
CN-1048852-A The α-Mi Dingyang of new replacement (sulphur) base-and α-triazine oxygen (sulphur) yl carboxylic acid derivative, their preparation method, and they are as weedicide, the application of sterilant and plant-growth regulator SCHERING AG (DE) 1991-01-30 CN disclosed
EP-0409368-A2 Substituted alfa pyrimidinyloxy carboxylic acid derivatives, process for their preparation and their use as an agent with herbicidal, fungicidal and plantgrowth regulating activity SCHERING AKTIENGESELLSCHAFT (DE) 1991-01-23 EP disclosed