SCHEMBL8634830

SCHEMBL8634830

COC(=O)C(Sc1nc(OC)cc(OC)n1)C(C)(F)c1cccs1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 8/20 0.35
EDNRA P25101 8/20 0.35
PTGES O14684 1/20 0.33
ALOX5 P09917 1/20 0.33
PPARG P37231 1/20 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
SCHEMBL8635507 0.79 EDNRB (0.49) EDNRBEDNRA
SCHEMBL7937196 0.75 EDNRB (0.49) EDNRBEDNRA
SCHEMBL8635313 0.74 EDNRB (0.57) EDNRBEDNRA
SCHEMBL8634031 0.72 HPGD (0.39)
SCHEMBL1069539 0.71 EDNRB (0.55) EDNRBEDNRA
SCHEMBL7928120 0.71 EDNRB (0.44) EDNRBEDNRAALOX5
SCHEMBL9051577 0.71 EDNRB (0.40) EDNRBEDNRA
SCHEMBL8109239 0.70 EDNRB (0.57) EDNRBEDNRA
SCHEMBL9051600 0.70 EDNRB (0.40) EDNRBEDNRA
SCHEMBL9050654 0.69 EDNRB (0.39) 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-5753594-A HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1998-05-19 US disclosed