SCHEMBL29030447

SCHEMBL29030447

CCCC=CS(=O)(=O)O.[NaH]

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
TAS1R3 Q7RTX0 1/20 0.31
TAS1R1 Q7RTX1 1/20 0.31
PPARA Q07869 2/20 0.31
NPC1 O15118 1/20 0.30
S1PR2 O95136 1/20 0.30
S1PR4 O95977 1/20 0.30
LMNA P02545 1/20 0.30
TP53 P04637 1/20 0.30
POLB P06746 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
XBP1 P17861 1/20 0.30
S1PR1 P21453 1/20 0.30
MAPK1 P28482 1/20 0.30
AGTR1 P30556 1/20 0.30
HTT P42858 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL17360994 1.00 ALDH1A1 (0.33) ALDH1A1TAS1R3TAS1R1PPARANPC1
SCHEMBL2723358 0.97
SCHEMBL14704011 0.97
SCHEMBL2723356 0.97
SCHEMBL29030444 0.86 PPARA (0.44) ALDH1A1PPARANPC1S1PR2S1PR4
SCHEMBL17361033 0.86 PPARA (0.44) ALDH1A1PPARANPC1S1PR2S1PR4
SCHEMBL17360996 0.84 PPARA (0.47) PPARALMNAPOLBMAPTNPSR1
SCHEMBL29030448 0.84 PPARA (0.47) PPARALMNAPOLBMAPTNPSR1
SCHEMBL1110006 0.83 PPARA (0.46) ALDH1A1PPARANPC1S1PR2S1PR4
SCHEMBL2863985 0.83 PPARA (0.46) ALDH1A1PPARANPC1S1PR2S1PR4

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116410364-A Polypropylene catalyst system loaded by organic carrier, and preparation method and application thereof 中国石油天然气股份有限公司 2023-07-11 CN claimed
CN-116410371-A Z-N type catalyst system for ethylene polymerization and preparation method and application thereof 中国石油天然气股份有限公司 2023-07-11 CN claimed
CN-115073627-B Porous organic polymer carrier metallocene catalyst system and preparation method and application thereof 中国石油天然气股份有限公司 2023-09-26 CN disclosed
CN-116410371-A Z-N type catalyst system for ethylene polymerization and preparation method and application thereof 中国石油天然气股份有限公司 2023-07-11 CN disclosed