SCHEMBL9367373

SCHEMBL9367373

CC=CC(Oc1nc(OC)cc(OC)n1)C(C)(C)C#N

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 18/20 0.38
EDNRA P25101 18/20 0.38
L3MBTL1 Q9Y468 1/20 0.33
RECQL P46063 1/20 0.31

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
SCHEMBL9367368 1.00 EDNRB (0.38) EDNRBEDNRAL3MBTL1RECQL
SCHEMBL9367315 0.72 EDNRB (0.59) EDNRBEDNRA
SCHEMBL9412740 0.70 EDNRB (0.43) EDNRBEDNRAL3MBTL1
SCHEMBL9295985 0.70 EDNRB (0.40) EDNRBEDNRAL3MBTL1RECQL
SCHEMBL9412661 0.66 EDNRB (0.39) EDNRBEDNRAL3MBTL1
SCHEMBL9411998 0.64 EDNRB (0.46) EDNRBEDNRAL3MBTL1
SCHEMBL9411994 0.64 EDNRB (0.46) EDNRBEDNRAL3MBTL1
SCHEMBL6335452 0.64 L3MBTL1 (0.48) EDNRBEDNRAL3MBTL1
SCHEMBL14298980 0.61 L3MBTL1 (0.46) EDNRBEDNRAL3MBTL1
SCHEMBL439716 0.61 LMNA (0.59) L3MBTL1

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
EP-0347811-B1 Alkanoic acid derivatives and herbicidal compositions KUMIAI CHEMICAL INDUSTRY CO (JP) 1994-03-30 EP disclosed
US-5087289-A ALKANOIC ACID DERIVATIVES AND HERBICIDAL COMPOSITIONS KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1992-02-11 US disclosed
US-4968340-A PREEMERGENCE KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1990-11-06 US disclosed
EP-0347811-A1 Alkanoic acid derivatives and herbicidal compositions KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1989-12-27 EP disclosed