SCHEMBL28939739

SCHEMBL28939739

Nn1c(C(F)(F)F)cc(=O)n(-c2cc(Sc3cccnc3O)c(Cl)cc2F)c1=O

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 2/20 0.31
PDE4D Q08499 2/20 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
SCHEMBL29574639 1.00 PDE4B (0.31) PDE4BPDE4D
SCHEMBL29709264 0.89 MAT2A (0.33) PDE4BPDE4D
SCHEMBL28738765 0.89 MAT2A (0.33) PDE4BPDE4D
SCHEMBL29574236 0.87
SCHEMBL29574443 0.84 PDK2 (0.31)
SCHEMBL29808392 0.84 PDK2 (0.31)
SCHEMBL29808545 0.83 PPOX (0.35)
SCHEMBL22923042 0.83 PPOX (0.35)
SCHEMBL22923044 0.83 ROCK2 (0.30)
SCHEMBL28736996 0.81 DHODH (0.32)

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
CN-114364666-A Substituted N-phenyl-N-semicarbazides pyrimidines and salts thereof and their use as herbicides 拜耳公司 2022-04-15 CN disclosed