SCHEMBL31344698

SCHEMBL31344698

COc1ccc(Sc2cc(Cl)cnc2C(N)=NO)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.43
PLG P00747 2/20 0.41
PLAU P00749 2/20 0.41
PLAT P00750 1/20 0.41
GAA P10253 1/20 0.41
ICAM1 P05362 1/20 0.40
SELE P16581 1/20 0.40
PTGIR P43119 2/20 0.39
CHEK2 O96017 1/20 0.39
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
KMT2A Q03164 1/20 0.36
KDM4E B2RXH2 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
EGLN1 Q9GZT9 1/20 0.35
HAO1 Q9UJM8 1/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
DHFR P00374 1/20 0.34

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
SCHEMBL31344739 0.83 PLAU (0.36) PLAUPLATICAM1SELEALDH1A1
SCHEMBL31344713 0.81 NPSR1 (0.43) PLAUGAAICAM1SELEMEN1
SCHEMBL31344693 0.74 PLAU (0.40) PLGPLAUPLATGAAALDH1A1
SCHEMBL31344690 0.72 NPSR1 (0.35) PLAU
SCHEMBL31344697 0.72 NPSR1 (0.40) PLAUALDH1A1
SCHEMBL11392611 0.71 HAO1 (0.46) IDO1GAAPTGIRMEN1ALDH1A1
SCHEMBL18796192 0.70 PTGIR (0.65) GAAPTGIRCHEK2ALDH1A1KMT2A
SCHEMBL4586975 0.68 PLAU (0.40) PLAUGAAALDH1A1KMT2AHTT
SCHEMBL16527613 0.66 MEN1 (0.53) IDO1MEN1ALDH1A1KMT2AKDM4E
SCHEMBL31344741 0.65 NPSR1 (0.50) PLAUGAAICAM1SELEMEN1

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-4724447-A1 SYNTHESIS OF CYCLIC ACYL SULFOXIMINES Syngenta Crop Protection AG (CH) 2026-04-15 EP disclosed
WO-2024252006-A1 SYNTHESIS OF CYCLIC ACYL SULFOXIMINES SYNGENTA CROP PROTECTION AG (CH) 2024-12-12 WO disclosed