SCHEMBL29329105

SCHEMBL29329105

CC(C)(C)OC(=O)NN(C(=O)OC(C)(C)C)c1cnc(Cl)c(F)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATR Q13535 1/20 0.37
S1PR3 Q99500 1/20 0.36
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
SYK P43405 1/20 0.34
AAK1 Q2M2I8 2/20 0.33
TRPA1 O75762 2/20 0.33
KCNQ4 P56696 1/20 0.33
KCNQ5 Q9NR82 1/20 0.33
STK17B O94768 1/20 0.32
STK17A Q9UEE5 1/20 0.32
PDPK1 O15530 1/20 0.32
SCN9A Q15858 2/20 0.31
RORC P51449 1/20 0.31
POLB P06746 1/20 0.31
MAPK1 P28482 1/20 0.31
ATM Q13315 1/20 0.31
P2RX3 P56373 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
SCHEMBL30046696 0.81 KAT8 (0.37) S1PR3SCN9AP2RX3
SCHEMBL23289665 0.81 KAT8 (0.37) S1PR3SCN9AP2RX3
SCHEMBL12395998 0.80 HDAC1 (0.32) S1PR3P2RX3
SCHEMBL18640713 0.79 KCNQ4 (0.36) ATRSYKTRPA1KCNQ4KCNQ5
SCHEMBL19249638 0.78 AAK1 (0.38) ATRCA12CA1CA2CA9
SCHEMBL20028519 0.78 AKT1 (0.35) ATRCA12CA1CA2CA9
SCHEMBL4550677 0.76 KCNQ4 (0.32) CA12CA1CA2CA9AAK1
SCHEMBL30147823 0.74 ATM (0.38) ATRRORCATM
SCHEMBL21604951 0.74 ATM (0.38) ATRRORCATM
SCHEMBL21183602 0.74 AKT1 (0.34) CA12CA1CA2CA9AAK1

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-4649076-A1 HERBICIDAL PYRAZOLE COMPOUNDS Syngenta Crop Protection AG (CH) 2025-11-19 EP disclosed
WO-2025021650-A1 HERBICIDAL PYRAZOLE COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2025-01-30 WO disclosed
WO-2024149676-A1 HERBICIDAL PYRAZOLE COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2024-07-18 WO disclosed
WO-2024149676-A1 HERBICIDAL PYRAZOLE COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2024-07-18 WO disclosed