SCHEMBL10596089

SCHEMBL10596089

O=C(OC(CS(=O)(=O)CC(OC(=O)c1ccccc1)OC(=O)c1ccccc1)OC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.53
TP53 P04637 1/20 0.53
LMNA P02545 4/20 0.47
F2 P00734 1/20 0.47
ALDH1A1 P00352 2/20 0.46
TDP1 Q9NUW8 2/20 0.44
PDCD1 Q15116 1/20 0.43
CD274 Q9NZQ7 1/20 0.43
SLC6A3 Q01959 2/20 0.43
MAPK1 P28482 1/20 0.43
HIF1A Q16665 1/20 0.43
SLC6A2 P23975 1/20 0.43
KMT2A Q03164 1/20 0.43
ESR1 P03372 1/20 0.42
ESR2 Q92731 1/20 0.42
CYP2D6 P10635 2/20 0.42
NPC1 O15118 1/20 0.41
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL416565 0.77 TSHR (0.57) TSHRTP53LMNAF2ALDH1A1
SCHEMBL27516477 0.77 TSHR (0.57) TSHRTP53LMNAF2ALDH1A1
SCHEMBL2013038 0.74 LMNA (0.55) TSHRTP53LMNAF2ALDH1A1
SCHEMBL1459546 0.74 TSHR (0.53) TSHRTP53LMNAF2ALDH1A1
SCHEMBL202540 0.74 TSHR (0.53) TSHRTP53LMNAF2ALDH1A1
SCHEMBL27782525 0.73 TSHR (0.52) TSHRTP53LMNAF2ALDH1A1
SCHEMBL13335240 0.73 TSHR (0.52) TSHRTP53LMNAF2ALDH1A1
SCHEMBL18759310 0.73 LMNA (0.49) TSHRTP53LMNAF2ALDH1A1
SCHEMBL28391084 0.71 TSHR (0.50) TSHRTP53LMNAF2ALDH1A1
SCHEMBL2650724 0.71 TSHR (0.65) TSHRTP53LMNAF2ALDH1A1

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
US-4847236-A Recording material FUJI PHOTO FILM CO., LTD. (JP) 1989-07-11 US disclosed