SCHEMBL9568651

SCHEMBL9568651

C=CC(=O)OCCNS(=O)(=O)CC

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.52
HPGD P15428 1/20 0.52
ALDH1A1 P00352 5/20 0.47
TP53 P04637 3/20 0.47
HIF1A Q16665 3/20 0.47
CYP3A4 P08684 2/20 0.47
HSD17B10 Q99714 1/20 0.47
THRB P10828 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.35
MAPK1 P28482 1/20 0.35
ATM Q13315 1/20 0.33
HCAR2 Q8TDS4 2/20 0.32
PTGES O14684 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
ZDHHC20 Q5W0Z9 1/20 0.30
ZDHHC2 Q9UIJ5 1/20 0.30

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
SCHEMBL27517006 0.90 TSHR (0.58) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL16038723 0.85 ATM (0.48) TSHRHPGDALDH1A1TP53SMN1; SMN2
SCHEMBL8685898 0.84 TSHR (0.48) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL29564360 0.83 TSHR (0.54) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL8560754 0.83 TSHR (0.54) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL9418374 0.81 TSHR (0.50) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL18405654 0.81 HCAR2 (0.48) ALDH1A1TP53SMN1; SMN2MAPK1ATM
SCHEMBL18405631 0.81 HCAR2 (0.45) TSHRHPGDALDH1A1HSD17B10SMN1; SMN2
SCHEMBL14293574 0.79 TSHR (0.38) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL11104966 0.77 TSHR (0.46) TSHRHPGDALDH1A1TP53HIF1A

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-0544264-A1 Light-sensitive composition FUJI PHOTO FILM CO., LTD. (JP) 1993-06-02 EP disclosed