SCHEMBL11087116

SCHEMBL11087116

COC(=O)c1ccccc1SN(Sc1ccccc1C(=O)OC)C(=O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.50
POLB P06746 2/20 0.50
SLC6A3 Q01959 1/20 0.49
TSHR P16473 3/20 0.49
TDP1 Q9NUW8 2/20 0.45
LMNA P02545 1/20 0.45
ALDH1A1 P00352 5/20 0.44
HPGD P15428 3/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
MAPT P10636 3/20 0.44
CFTR P13569 1/20 0.44
ALOX15 P16050 1/20 0.43
KDM4E B2RXH2 5/20 0.43
ATM Q13315 1/20 0.42
PKLR P30613 1/20 0.42
MYC P01106 1/20 0.42
KMT2A Q03164 4/20 0.42
MEN1 O00255 1/20 0.42
ALOX12 P18054 1/20 0.42
GAA P10253 1/20 0.42

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
SCHEMBL11087143 0.84 HSD17B10 (0.47) HSD17B10POLBSLC6A3TSHRTDP1
SCHEMBL11092090 0.83 HSD17B10 (0.54) HSD17B10POLBSLC6A3TSHRTDP1
SCHEMBL11092602 0.81 HSD17B10 (0.53) HSD17B10POLBSLC6A3TSHRTDP1
SCHEMBL11091729 0.77 HSD17B10 (0.51) HSD17B10POLBSLC6A3TSHRTDP1
SCHEMBL11091475 0.76 HSD17B10 (0.50) HSD17B10POLBSLC6A3TSHRTDP1
SCHEMBL11085797 0.75 HSD17B10 (0.49) HSD17B10POLBSLC6A3TSHRTDP1
SCHEMBL756511 0.75 POLB (0.64) HSD17B10POLBSLC6A3TSHRTDP1
SCHEMBL30096217 0.75 POLB (0.64) HSD17B10POLBSLC6A3TSHRTDP1
SCHEMBL4440485 0.75 HSD17B10 (0.64) HSD17B10POLBSLC6A3TSHRTDP1
SCHEMBL11080035 0.74 HSD17B10 (0.48) HSD17B10POLBSLC6A3TSHRTDP1

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-4469874-A ALKYL THIOSALICYLATES MONSANTO COMPANY (US) 1984-09-04 US disclosed
US-4283508-A Fragrant prevulcanization inhibitors MONSANTO COMPANY (US) 1981-08-11 US disclosed