SCHEMBL9306492

SCHEMBL9306492

COc1ccc(C(OCCS(=O)(=O)C(C)O)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A11 P48066 4/20 0.45
SLC6A1 P30531 2/20 0.45
KMT2A Q03164 2/20 0.44
KIF11 P52732 6/20 0.41
MEN1 O00255 1/20 0.40
TP53 P04637 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
SLC6A12 P48065 1/20 0.40
SLC6A13 Q9NSD5 1/20 0.40
HSD11B1 P28845 1/20 0.39

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
SCHEMBL9070312 0.83 SLC6A11 (0.40) SLC6A11SLC6A1KMT2AKIF11MEN1
SCHEMBL9305521 0.83 SLC6A11 (0.40) SLC6A11SLC6A1KMT2AKIF11MEN1
SCHEMBL7010042 0.81 SLC6A11 (0.46) SLC6A11SLC6A1KMT2AKIF11MEN1
SCHEMBL5967855 0.80 SLC6A11 (0.49) SLC6A11SLC6A1KMT2AKIF11MEN1
SCHEMBL5604595 0.80 SLC6A11 (0.49) SLC6A11SLC6A1KMT2AKIF11MEN1
SCHEMBL5604514 0.80 SLC6A11 (0.49) SLC6A11SLC6A1KMT2AKIF11MEN1
SCHEMBL8655117 0.79 SLC6A11 (0.44) SLC6A11SLC6A1KMT2AKIF11MEN1
SCHEMBL8388886 0.79 SLC6A11 (0.44) SLC6A11SLC6A1KMT2AKIF11MEN1
SCHEMBL27013149 0.79 SLC6A11 (0.44) SLC6A11SLC6A1KMT2AKIF11MEN1
SCHEMBL6838818 0.78 SLC6A11 (0.48) SLC6A11SLC6A1KMT2AKIF11MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5332845-A In DNA synthesis CHIRON CORPORATION (US) 1994-07-26 US disclosed
US-5252760-A Method of using colored phosphorylating reagents CHIRON CORPORATION (US) 1993-10-12 US disclosed
EP-0304215-A2 Phosphorylating reagents and method of using the same CHIRON CORPORATION (US) 1989-02-22 EP disclosed