SCHEMBL27680394

SCHEMBL27680394

C=Cc1ccccc1OCS(=O)(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
HPGD P15428 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
HTT P42858 1/20 0.43
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
HSD17B10 Q99714 1/20 0.41
PTGDR2 Q9Y5Y4 1/20 0.40
KMT2A Q03164 5/20 0.38
MAPT P10636 4/20 0.38
KDM4E B2RXH2 2/20 0.38
PSMD14 O00487 1/20 0.38
CRHBP P24387 1/20 0.38
PPARG P37231 1/20 0.38
CRHR2 Q13324 1/20 0.38
CTDSP1 Q9GZU7 1/20 0.38
CCNB2 O95067 1/20 0.35
CDK1 P06493 1/20 0.35
CDK4 P11802 1/20 0.35
CCNB1 P14635 1/20 0.35

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
SCHEMBL19342153 0.84 ALDH1A1 (0.63) ALDH1A1HPGDSMN1; SMN2HTTPTGDR2
SCHEMBL5151035 0.83 HPGD (0.44) ALDH1A1HPGDSMN1; SMN2HTTTSHR
SCHEMBL5153392 0.82 HPGD (0.43) ALDH1A1HPGDSMN1; SMN2HTTTSHR
Sulfuric Acid SCHEMBL28268172 0.78 LMNA (0.41) ALDH1A1HPGDSMN1; SMN2HTTTSHR
SCHEMBL29743115 0.77 ALDH1A1 (0.43) ALDH1A1HPGDSMN1; SMN2HTTTSHR
SCHEMBL731975 0.77 ALDH1A1 (0.43) ALDH1A1HPGDSMN1; SMN2HTTTSHR
Trifluoromethanesulfonic Acid SCHEMBL27793822 0.75 HPGD (0.52) ALDH1A1HPGDSMN1; SMN2HTTTSHR
SCHEMBL28986963 0.75 ALDH1A1 (0.42) ALDH1A1HPGDSMN1; SMN2HTTTSHR
SCHEMBL560229 0.74 GAA (0.55) ALDH1A1HPGDSMN1; SMN2TSHRHSD17B10
SCHEMBL4726054 0.74 ALDH1A1 (0.48) ALDH1A1HPGDSMN1; SMN2HTTTSHR

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-1955200-B Multi-nuclear metallocene catalyst and method for preparing synodiotactic polystyrene using the multi-nuclear metallocene catalyst LG ELECTRONICS INC 2011-08-31 CN disclosed
CN-1955194-B Semi-metallocene catalyst and method for preparing syndiotactic styrene polymer us the semi-metallocene catalyst LG CHEMICAL LTD 2011-06-08 CN disclosed
CN-1955194-A Semi-metallocene catalyst and method for preparing syndiotactic styrene polymer us the semi-metallocene catalyst LG CHEMICAL LTD (KR) 2007-05-02 CN disclosed
CN-1955200-A Multi-nuclear metallocene catalyst and method for preparing synodiotactic polystyrene using the multi-nuclear metallocene catalyst LG CHEMICAL LTD (KR) 2007-05-02 CN disclosed