SCHEMBL7896751

SCHEMBL7896751

Cc1cccc(S(=O)(=O)S(=O)(=O)c2cccc(C)c2C)c1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.47
KEAP1 Q14145 1/20 0.47
NFE2L2 Q16236 1/20 0.47
TRPA1 O75762 1/20 0.42
ATM Q13315 1/20 0.42
TSHR P16473 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ALDH1A1 P00352 3/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MAPK1 P28482 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2A6 P11509 1/20 0.38
MAPT P10636 1/20 0.36
ACHE P22303 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
EDNRA P25101 1/20 0.36
MEN1 O00255 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
SCHEMBL1538438 0.85 KMT2A (0.56) KMT2AKEAP1NFE2L2TRPA1ATM
SCHEMBL3796970 0.83 KEAP1 (0.50) KMT2AKEAP1NFE2L2TRPA1ATM
SCHEMBL330834 0.83 KMT2A (0.46) KMT2AKEAP1NFE2L2TRPA1ATM
SCHEMBL29604136 0.83 KEAP1 (0.50) KMT2AKEAP1NFE2L2TRPA1ATM
SCHEMBL691798 0.81 KMT2A (0.45) KMT2AKEAP1NFE2L2TRPA1ATM
SCHEMBL3780 0.81 MYC (0.46) KMT2AKEAP1NFE2L2TRPA1ATM
SCHEMBL31506947 0.81 MYC (0.46) KMT2AKEAP1NFE2L2TRPA1ATM
SCHEMBL6113033 0.81 KMT2A (0.45) KMT2AKEAP1NFE2L2TRPA1ATM
SCHEMBL401308 0.81 CA2 (0.47) KMT2AKEAP1NFE2L2TRPA1ATM
SCHEMBL31310995 0.81 CA2 (0.47) KMT2AKEAP1NFE2L2TRPA1ATM

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
US-6183934-B1 FOE USE IN FORMATION OF PATTERN OF INSULATION FILM, PASSIVATION FILM, .ALPHA.-RAY SHIELDING FILM, OPTICAL WAVEGUIDE KABUSHIKI KAISHA TOSHIBA (JP) 2001-02-06 US disclosed