SCHEMBL11114440

SCHEMBL11114440

O=S(=O)(Cc1ccc(O)cc1)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.61
TSHR P16473 2/20 0.58
HSD17B10 Q99714 1/20 0.58
DAO P14920 1/20 0.49
PSIP1 O75475 1/20 0.48
FNTA P49354 1/20 0.47
FNTB P49356 1/20 0.47
CA2 P00918 1/20 0.46
HSD11B1 P28845 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MMP2 P08253 1/20 0.44
LMNA P02545 1/20 0.44
ESR1 P03372 2/20 0.44
TAS2R14 Q9NYV8 1/20 0.43

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
SCHEMBL2921402 0.92 TSHR (0.68) MAPTTSHRHSD17B10DAOFNTA
SCHEMBL21510835 0.90 CA2 (0.55) MAPTTSHRHSD17B10PSIP1FNTA
SCHEMBL11048869 0.90 CA2 (0.55) MAPTTSHRHSD17B10PSIP1FNTA
Benzylsulfonylbenzene SCHEMBL780337 0.85 TSHR (0.68) MAPTTSHRHSD17B10DAOPSIP1
Benzylsulfonylbenzene SCHEMBL1877584 0.83 TSHR (0.66) MAPTTSHRHSD17B10DAOPSIP1
SCHEMBL5002569 0.81 MAPT (0.57) MAPTTSHRHSD17B10CA2LMNA
SCHEMBL2922447 0.81 POLB (0.49) MAPTTSHRHSD17B10CA2MMP2
SCHEMBL28887988 0.81 MAPT (0.57) MAPTTSHRHSD17B10CA2LMNA
SCHEMBL3668383 0.80 MAPT (0.61) MAPTTSHRHSD17B10PSIP1HSD11B1
SCHEMBL22511307 0.80 MAPT (0.61) MAPTTSHRHSD17B10DAOPSIP1

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-0112291-A2 Heat-sensitive registration material CIBA-GEIGY AG (CH) 1984-06-27 EP disclosed
EP-0067793-A2 Pressure or heat sensitive recording materials CIBA-GEIGY AG (CH) 1982-12-22 EP disclosed