SCHEMBL9017802

SCHEMBL9017802

Cc1ccc(O)c(S)c1N

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.48
TSHR P16473 1/20 0.43
CASP1 P29466 1/20 0.43
TP53 P04637 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
POLB P06746 1/20 0.41
HSD17B10 Q99714 3/20 0.38
ALDH1A1 P00352 3/20 0.38
ALOX15 P16050 1/20 0.38
ESR1 P03372 6/20 0.37
ESR2 Q92731 4/20 0.37
AR P10275 3/20 0.36
CD44 P16070 1/20 0.36
GAA P10253 3/20 0.34
GFER P55789 1/20 0.34
MAPT P10636 2/20 0.33
NOS3 P29474 1/20 0.33
NOS2 P35228 1/20 0.33
KDM4E B2RXH2 1/20 0.33
LMNA P02545 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
SCHEMBL104361 0.79 POLB (0.48) PDE10ATSHRCASP1TP53TDP1
SCHEMBL31634585 0.77 PDE10A (0.54) PDE10ATSHRCASP1TP53TDP1
SCHEMBL4968725 0.77 PDE10A (0.54) PDE10ATSHRCASP1TP53TDP1
SCHEMBL3517813 0.75 EP300 (0.41) TSHRTDP1POLBHSD17B10ALDH1A1
SCHEMBL28193310 0.75 POLB (0.44) TSHRCASP1TP53TDP1POLB
SCHEMBL10512501 0.75 TRPA1 (0.44) PDE10ATSHRCASP1TP53TDP1
SCHEMBL3080081 0.75 POLB (0.44) PDE10ATSHRCASP1TP53TDP1
SCHEMBL30962921 0.75 POLB (0.56) PDE10ATSHRCASP1TP53TDP1
SCHEMBL31495833 0.75 PDE10A (0.52) PDE10ATSHRCASP1TP53TDP1
SCHEMBL1233639 0.75 POLB (0.56) PDE10ATSHRCASP1TP53TDP1

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-0591060-B1 4-Substituted meta amino phenols, process for their preparation their use in dyeing keratinic fibres and intermediates used in their preparation OREAL (FR) 1996-12-18 EP disclosed
EP-0591060-A1 4-Substituted meta amino phenols, process for their preparation their use in dyeing keratinic fibres and intermediates used in their preparation L'OREAL (FR) 1994-04-06 EP disclosed