SCHEMBL11337145

SCHEMBL11337145

C=CS(=O)(=O)c1ccc(OC)cc1C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.51
PKM P14618 2/20 0.51
L3MBTL1 Q9Y468 2/20 0.50
ALDH1A1 P00352 3/20 0.42
LMNA P02545 2/20 0.42
NPC1 O15118 1/20 0.42
TP53 P04637 1/20 0.42
MAPT P10636 1/20 0.42
TSHR P16473 1/20 0.42
XBP1 P17861 1/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 1/20 0.42
RAB9A P51151 1/20 0.42
MDM2 Q00987 1/20 0.42
HSD17B10 Q99714 1/20 0.42
FFAR4 Q5NUL3 3/20 0.41
PDIA6 Q15084 1/20 0.41
APLNR P35414 1/20 0.41
RAPGEF4 Q8WZA2 1/20 0.39
TUBB1 Q9H4B7 1/20 0.39

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
SCHEMBL11334756 0.86 ALDH1A1 (0.44) SMN1; SMN2PKML3MBTL1ALDH1A1LMNA
SCHEMBL11335502 0.83 ALDH1A1 (0.47) L3MBTL1ALDH1A1MAPTTSHRMAPK1
SCHEMBL11323947 0.83 SMN1; SMN2 (0.42) SMN1; SMN2PKML3MBTL1ALDH1A1LMNA
SCHEMBL11333866 0.83 SMN1; SMN2 (0.42) SMN1; SMN2PKML3MBTL1ALDH1A1LMNA
SCHEMBL1817467 0.80 PKM (0.55) SMN1; SMN2PKML3MBTL1ALDH1A1LMNA
SCHEMBL4203848 0.80 PKM (0.58) SMN1; SMN2PKML3MBTL1ALDH1A1LMNA
SCHEMBL11327832 0.79 L3MBTL1 (0.58) SMN1; SMN2L3MBTL1ALDH1A1LMNATP53
SCHEMBL10497795 0.79 SMN1; SMN2 (0.54) SMN1; SMN2PKML3MBTL1ALDH1A1LMNA
SCHEMBL7034798 0.78 ALDH1A1 (0.44) SMN1; SMN2PKMALDH1A1LMNAMAPT
SCHEMBL12036349 0.78 SMN1; SMN2 (0.57) SMN1; SMN2PKML3MBTL1ALDH1A1LMNA

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
US-4260552-A INSECTICIDES, HERBICIDES UNIROYAL, INC. (US) 1981-04-07 US disclosed
US-4160846-A Method for controlling insects with tetrasubstituted organotin compounds UNIROYAL, INC. (US) 1979-07-10 US disclosed