SCHEMBL9843356

SCHEMBL9843356

C=C(CS(=O)(=O)CP(=O)(O)O)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 4/20 0.38
MAOB P27338 4/20 0.38
PTGES2 Q9H7Z7 1/20 0.36
CYP1A2 P05177 2/20 0.35
CYP3A4 P08684 2/20 0.35
CYP2C9 P11712 2/20 0.35
TSHR P16473 2/20 0.35
MEN1 O00255 2/20 0.34
ALDH1A1 P00352 2/20 0.34
KMT2A Q03164 2/20 0.34
CA12 O43570 1/20 0.34
MMP2 P08253 1/20 0.34
CA9 Q16790 1/20 0.34
CA14 Q9ULX7 1/20 0.34
MAPT P10636 2/20 0.33
TRPA1 O75762 1/20 0.33
MAPK1 P28482 1/20 0.33
GSK3B P49841 1/20 0.33
HIF1A Q16665 1/20 0.33
CFTR P13569 1/20 0.33

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
SCHEMBL28526172 0.83 MAOA (0.47) MAOAMAOBPTGES2CYP3A4TSHR
SCHEMBL10701243 0.78 MAOA (0.42) MAOAMAOBALDH1A1MAPT
SCHEMBL9436499 0.77 MAOA (0.39) MAOAMAOBPTGES2CYP3A4MEN1
SCHEMBL9498520 0.75 SMN1; SMN2 (0.48) TSHRALDH1A1MMP2CA9
SCHEMBL2866425 0.74 MAOA (0.45) MAOAMAOBPTGES2CYP3A4TSHR
SCHEMBL15413487 0.72 MAOA (0.44) MAOAMAOBCA12CA9CA14
SCHEMBL9488126 0.72 MAOA (0.44) MAOAMAOBPTGES2CYP3A4TSHR
SCHEMBL9645780 0.71 CES2 (0.41) MAOAMAOB
SCHEMBL9488123 0.71 MAOA (0.42) MAOAMAOBPTGES2CYP3A4MEN1
SCHEMBL9494682 0.71 HSD11B1 (0.52) MEN1ALDH1A1KMT2ACA12MMP2

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-0435794-A1 Alkenyl- or heteroaryl thio, sulfone, sulfoxy herbicides RHONE-POULENC AGROCHIMIE (FR) 1991-07-03 EP disclosed