SCHEMBL22355665

SCHEMBL22355665

COc1cnc(-c2cc[n+](CCS(=O)(=O)[O-])nc2)nc1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.36
PABPC1 P11940 1/20 0.32
EIF4H Q15056 1/20 0.32
CTDSP1 Q9GZU7 1/20 0.32
P4HTM Q9NXG6 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
SCHEMBL24001053 0.89 LMNA (0.33) LMNA
SCHEMBL20753382 0.87 KDM4E (0.32)
SCHEMBL22355716 0.85 CA12 (0.39)
SCHEMBL20753724 0.85 MAP4K4 (0.30)
SCHEMBL20753548 0.84 APLNR (0.32)
SCHEMBL20753530 0.84 NPC1 (0.32)
SCHEMBL20744260 0.84 CYP2A6 (0.34) PABPC1EIF4HCTDSP1
SCHEMBL20753287 0.84
SCHEMBL20753317 0.82 PTGS2 (0.35) LMNA
SCHEMBL20753812 0.82 CA12 (0.30)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3668855-B1 HERBICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2021-11-10 EP disclosed
WO-2020164971-A1 PRE-HARVEST DESICCATION METHOD SYNGENTA CROP PROTECTION AG (CH) 2020-08-20 WO disclosed