SCHEMBL1584589

SCHEMBL1584589

Cc1ccc(CC(=O)O)cc1OCc1c(C)ccc(OS(=O)(=O)Oc2ccc(C)c(COc3cc(CC(=O)O)ccc3C)c2C)c1C

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 2/20 0.67
CA5A P35218 1/20 0.47
RXRA P19793 3/20 0.44
RXRB P28702 3/20 0.44
RXRG P48443 3/20 0.44
FFAR4 Q5NUL3 4/20 0.41
FFAR1 O14842 2/20 0.41
GAA P10253 2/20 0.40
TSHR P16473 2/20 0.40
ALDH1A1 P00352 1/20 0.40
NFKB1 P19838 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
PPARD Q03181 1/20 0.36
SLC26A3 P40879 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL1584592 0.92 SLC22A12 (0.66) SLC22A12CA5ARXRARXRBRXRG
SCHEMBL1584507 0.86 SLC22A12 (0.72) SLC22A12CA5ARXRARXRBRXRG
SCHEMBL1584528 0.83 SLC22A12 (0.74) SLC22A12CA5ARXRARXRBRXRG
SCHEMBL460443 0.81 SLC22A12 (1.00) SLC22A12RXRARXRBRXRGFFAR4
SCHEMBL1584983 0.74 SLC22A12 (0.54) SLC22A12GAAALDH1A1MEN1KMT2A
SCHEMBL7897205 0.73 SLC22A12 (0.67) SLC22A12CA5ARXRARXRBRXRG
SCHEMBL955065 0.73 SLC22A12 (0.78) SLC22A12CA5ARXRARXRBRXRG
SCHEMBL17316708 0.71 SLC22A12 (0.60) SLC22A12CA5ARXRARXRBRXRG
SCHEMBL334173 0.71 SLC22A12 (0.63) SLC22A12CA5ARXRARXRBRXRG
SCHEMBL956632 0.70 SLC22A12 (0.78) SLC22A12RXRARXRBRXRGFFAR4

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
EP-2488020-B1 3-SUBSTITUTED COMPOUNDS FOR REDUCING URIC ACID WELLSTAT THERAPEUTICS CORP (US) 2016-12-14 EP disclosed
EP-2488020-A1 3-SUBSTITUTED COMPOUNDS FOR REDUCING URIC ACID Wellstat Therapeutics Corporation (US) 2012-08-22 EP disclosed
WO-2011046800-A1 3-SUBSTITUTED COMPOUNDS FOR REDUCING URIC ACID WELLSTAT THERAPEUTICS CORPORATION (US) 2011-04-21 WO disclosed