SCHEMBL29709264

SCHEMBL29709264

Cn1c(C(F)(F)F)cc(=O)n(-c2cc(Sc3cccnc3O)c(Cl)cc2F)c1=O

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAT2A P31153 1/20 0.33
GRM4 Q14833 2/20 0.31
PDE4B Q07343 2/20 0.31
PDE4D Q08499 2/20 0.31
GAA P10253 1/20 0.31
ATM Q13315 1/20 0.31
PTPN11 Q06124 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
SCHEMBL28738765 1.00 MAT2A (0.33) MAT2AGRM4PDE4BPDE4DGAA
SCHEMBL29574639 0.89 PDE4B (0.31) PDE4BPDE4D
SCHEMBL28939739 0.89 PDE4B (0.31) PDE4BPDE4D
SCHEMBL29709315 0.87 CYP1A2 (0.30)
SCHEMBL28738807 0.87 CYP1A2 (0.30)
SCHEMBL29709398 0.85 PKM (0.34)
SCHEMBL22912594 0.84 DHODH (0.30)
SCHEMBL29709296 0.84 PPOX (0.36) ATM
SCHEMBL29911629 0.84 PPOX (0.36) ATM
SCHEMBL22912590 0.83 DHODH (0.34)

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
EP-4003981-A1 SUBSTITUTED N-PHENYL URACILS, SALTS THEREOF AND THEIR USE AS HERBICIDAL AGENTS Bayer Aktiengesellschaft (DE) 2022-06-01 EP disclosed