SCHEMBL28092304

SCHEMBL28092304

CCc1cc(C)ccc1S(=O)(=O)Oc1cccs1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
SMN1; SMN2 Q16637 4/20 0.36
RAPGEF4 Q8WZA2 1/20 0.35
TSHR P16473 3/20 0.34
CASP1 P29466 1/20 0.34
CASP7 P55210 1/20 0.34
HSD17B10 Q99714 1/20 0.34
ALDH1A1 P00352 5/20 0.34
MAPT P10636 2/20 0.34
LMNA P02545 3/20 0.34
HTT P42858 1/20 0.34
HPGD P15428 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
KMT2A Q03164 3/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
ATM Q13315 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
SCHEMBL10995940 0.77 LMNA (0.44) TDP1L3MBTL1SMN1; SMN2RAPGEF4TSHR
SCHEMBL2656784 0.74 RAPGEF4 (0.37) L3MBTL1SMN1; SMN2RAPGEF4TSHRCASP1
SCHEMBL6938283 0.74 KEAP1 (0.45) SMN1; SMN2ALDH1A1MAPTLMNAHTT
SCHEMBL21388018 0.74 TSHR (0.41) L3MBTL1SMN1; SMN2RAPGEF4TSHRCASP1
SCHEMBL29624394 0.74 TSHR (0.41) L3MBTL1SMN1; SMN2RAPGEF4TSHRCASP1
Alcohol SCHEMBL7454876 0.73 KMT2A (0.47) L3MBTL1RAPGEF4HSD17B10ALDH1A1MAPT
SCHEMBL28823865 0.72 RAPGEF4 (0.38) L3MBTL1SMN1; SMN2RAPGEF4TSHRCASP1
SCHEMBL15018736 0.72 RAPGEF4 (0.38) L3MBTL1SMN1; SMN2RAPGEF4TSHRCASP1
SCHEMBL31337347 0.72 MAPT (0.41) TDP1L3MBTL1SMN1; SMN2RAPGEF4TSHR
SCHEMBL21590192 0.71 LMNA (0.45) TDP1L3MBTL1SMN1; SMN2RAPGEF4TSHR

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
CN-103509037-B A kind of clopidogrel and the preparation method of intermediate thereof 山东鲁药制药有限公司 2016-08-31 CN disclosed