SCHEMBL22923046

SCHEMBL22923046

Nn1c(C(F)(F)F)cc(=O)n(-c2cc(Sc3cccnc3OCC(=O)OCc3ccccc3)c(Cl)cc2F)c1=O

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.30

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
SCHEMBL29808521 1.00 ALDH1A1 (0.31) ALDH1A1POLB
SCHEMBL29808640 0.93 POLB (0.31) ALDH1A1POLB
SCHEMBL22923108 0.93 POLB (0.31) ALDH1A1POLB
SCHEMBL22923042 0.91 PPOX (0.35) ALDH1A1
SCHEMBL29808545 0.91 PPOX (0.35) ALDH1A1
SCHEMBL29574443 0.89 PDK2 (0.31)
SCHEMBL29808392 0.89 PDK2 (0.31)
SCHEMBL29808375 0.88 ALDH1A1 (0.34) ALDH1A1
SCHEMBL22923043 0.88 ALDH1A1 (0.34) ALDH1A1
SCHEMBL22923057 0.87 ALDH1A1 (0.32) ALDH1A1

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-2021013800-A1 SUBSTITUTED N-PHENYL-N-AMINOUARCILS AND SALTS THEREOF AND USE THEREOF AS HERBICIDAL AGENTS BAYER AKTIENGESELLSCHAFT (DE) 2021-01-28 WO disclosed