SCHEMBL27466835

SCHEMBL27466835

CC(C)(C)OS(=O)(=O)c1ccccc1C(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 3/20 0.41
ALDH1A1 P00352 3/20 0.39
TDP1 Q9NUW8 2/20 0.39
TSHR P16473 1/20 0.39
RBP4 P02753 1/20 0.38
CA2 P00918 1/20 0.35
KDM4E B2RXH2 1/20 0.34
ATM Q13315 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
HSD17B3 P37058 1/20 0.33
HTR6 P50406 3/20 0.32

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
SCHEMBL29415223 0.85 HTR6 (0.36) HSD11B1ALDH1A1TDP1TSHRCA2
SCHEMBL16045449 0.85 HTR6 (0.36) HSD11B1ALDH1A1TDP1TSHRCA2
SCHEMBL28318013 0.85 HSD11B1 (0.45) HSD11B1ALDH1A1TDP1TSHRRBP4
SCHEMBL27515369 0.82 HSD11B1 (0.37) HSD11B1ALDH1A1TDP1TSHRRBP4
SCHEMBL9312078 0.80 CA2 (0.45) HSD11B1ALDH1A1TDP1TSHRRBP4
SCHEMBL9360088 0.76 HSD11B1 (0.54) HSD11B1ALDH1A1TDP1TSHRRBP4
SCHEMBL4135165 0.76 KMT2A (0.43) HSD11B1ALDH1A1TDP1MEN1KMT2A
SCHEMBL7464033 0.76 RBP4 (0.44) HSD11B1ALDH1A1TDP1TSHRRBP4
SCHEMBL7809492 0.74 HSD11B1 (0.45) HSD11B1ALDH1A1TDP1TSHRRBP4
SCHEMBL15935170 0.73 ALDH1A1 (0.52) HSD11B1ALDH1A1TDP1TSHRRBP4

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-1151408-A Catalyst for olefin polymerization and process for producing olefin polymer using the same MITSUBISHI CHEM CORP (JP) 1997-06-11 CN disclosed