SCHEMBL20753530

SCHEMBL20753530

O=S(=O)([O-])CC[n+]1ccc(-c2ncc(Cl)cn2)cn1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL20753548 0.86 APLNR (0.32)
SCHEMBL20753382 0.86 KDM4E (0.32)
SCHEMBL20744260 0.86 CYP2A6 (0.34)
SCHEMBL20753400 0.85 CNR2 (0.34) SMN1; SMN2
SCHEMBL20753812 0.84 CA12 (0.30)
SCHEMBL22355665 0.84 LMNA (0.36)
SCHEMBL20753724 0.84 MAP4K4 (0.30)
SCHEMBL24001132 0.83 NPC1 (0.35) NPC1RAB9ASMN1; SMN2HSD17B10
SCHEMBL20753287 0.83
SCHEMBL22355645 0.83 HDAC4 (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 3 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
WO-2019034757-A1 HERBICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2019-02-21 WO disclosed