SCHEMBL9296713

SCHEMBL9296713

COc1cc(OC)nc(OC(C(N)=S)C(C)(C)C)n1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 18/20 0.47
EDNRA P25101 18/20 0.47
L3MBTL1 Q9Y468 1/20 0.37
LMNA P02545 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL9297445 0.80 EDNRB (0.43) EDNRBEDNRAL3MBTL1
SCHEMBL9367683 0.79 EDNRB (0.66) EDNRBEDNRALMNATDP1
SCHEMBL7811183 0.78 EDNRB (0.55) EDNRBEDNRA
SCHEMBL9372708 0.78 EDNRB (0.64) EDNRBEDNRALMNATDP1
SCHEMBL9372696 0.77 EDNRB (0.52) EDNRBEDNRALMNATDP1
SCHEMBL9459188 0.71 EDNRB (0.63) EDNRBEDNRALMNATDP1
SCHEMBL9119578 0.71 EDNRB (0.65) EDNRBEDNRA
SCHEMBL9459403 0.70 EDNRB (0.53) EDNRBEDNRAL3MBTL1
SCHEMBL9373008 0.69 EDNRB (0.60) EDNRBEDNRA
SCHEMBL14298980 0.69 L3MBTL1 (0.46) EDNRBEDNRAL3MBTL1LMNATDP1

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-5318945-A Herbicides; plant growth regulators; pyrimidin-2-yl-oxy- or thio-derivatives BASF AKTIENGESELLSCHAFT (DE) 1994-06-07 US disclosed