SCHEMBL8633569

SCHEMBL8633569

CC(C)(C)c1ccc(S(=O)(=O)O)c([Si](C)(C)C)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.38
HPGD P15428 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
ALOX15 P16050 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA9 Q16790 2/20 0.38
NPC1 O15118 1/20 0.37
PLA2G1B P04054 1/20 0.37
NFKB1 P19838 1/20 0.37
CASP3 P42574 1/20 0.37
RAB9A P51151 1/20 0.37
NFKB2 Q00653 1/20 0.37
RELA Q04206 1/20 0.37
SENP8 Q96LD8 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
SENP6 Q9GZR1 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ATG4B Q9Y4P1 1/20 0.37

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
SCHEMBL8660809 0.86 CA1 (0.39) ALDH1A1HPGDTDP1ALOX15HSD17B10
SCHEMBL8661123 0.81 ALDH1A1 (0.35) ALDH1A1HPGDTDP1ALOX15HSD17B10
SCHEMBL939874 0.78 GAA (0.40) ALDH1A1HPGDTDP1HSD17B10CA1
SCHEMBL17752315 0.77 LMNA (0.44) ALDH1A1HPGDTDP1ALOX15HSD17B10
SCHEMBL8633774 0.76 TET2 (0.36) CA1CA2CA9KMT2ATSHR
SCHEMBL10712507 0.76 CA12 (0.34) CA1CA2CA9LMNASMN1; SMN2
Water SCHEMBL3135477 0.76 GAA (0.39) ALDH1A1HPGDTDP1HSD17B10CA1
SCHEMBL2337672 0.76 ALDH1A1 (0.57) ALDH1A1HPGDTDP1ALOX15HSD17B10
SCHEMBL23084667 0.74 CYP2C19 (0.45) ALDH1A1HPGDTDP1ALOX15HSD17B10
SCHEMBL2748203 0.74 ALDH1A1 (0.41) ALDH1A1HPGDTDP1ALOX15HSD17B10

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-5847218-A Sulfonium salts and chemically amplified positive resist compositions SHIN-ETSU CHEMICAL CO., LTD. (JP) 1998-12-08 US disclosed
US-5705702-A REACTING AN ARYL GRIGNARD REAGENT WITH THIONYL CHLORIDE, THEN WITH TRIORGANOSILYL SULFONATE OR TRIORGANOSILYLHALIDE SHIN-ETSU CHEMICAL CO., LTD. (JP) 1998-01-06 US disclosed