SCHEMBL29048698

SCHEMBL29048698

COC(=O)CS(=O)(=O)CC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.41
HSD17B10 Q99714 1/20 0.41
CA12 O43570 6/20 0.38
CA14 Q9ULX7 6/20 0.38
CA2 P00918 3/20 0.37
MGAM O43451 1/20 0.36
GAA P10253 1/20 0.36
SI P14410 1/20 0.36
MGAM2 Q2M2H8 1/20 0.36
TET2 Q6N021 1/20 0.34
CA9 Q16790 3/20 0.34
CA7 P43166 2/20 0.34
CA1 P00915 1/20 0.34
RECQL P46063 1/20 0.33
EPHX2 P34913 1/20 0.31
POLB P06746 2/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
MAPT P10636 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL10622350 0.81 TSHR (0.52) TSHRHSD17B10CA12CA14CA2
SCHEMBL6984208 0.81 TSHR (0.39) TSHRHSD17B10CA12CA14CA2
SCHEMBL1843089 0.77 CA12 (0.47) TSHRHSD17B10CA12CA14CA2
SCHEMBL10260586 0.77 TSHR (0.48) TSHRHSD17B10CA12CA14CA2
SCHEMBL14945717 0.75 POLB (0.32) POLBSMN1; SMN2
SCHEMBL829575 0.73 POLB (0.62) TSHRHSD17B10CA12CA14CA2
SCHEMBL11486883 0.73 TSHR (0.42) TSHRHSD17B10CA12CA14CA2
SCHEMBL28692819 0.71 TSHR (0.52) TSHRHSD17B10CA12CA14CA2
SCHEMBL10498703 0.71 TSHR (0.42) TSHRHSD17B10CA12CA14CA2
SCHEMBL20743414 0.71 CA12 (0.39) TSHRHSD17B10CA12CA14CA2

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
CN-113453554-B herbicidal composition 先正达农作物保护股份公司 2023-09-05 CN disclosed
CN-111032640-B Herbicidal compounds 先正达参股股份有限公司 2023-08-08 CN disclosed