SCHEMBL28856548

SCHEMBL28856548

CC(C)c1ccc(-c2ccc(SC(C)(C)C(=O)O)s2)c2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 1/20 0.47
▸ SLC22A12 Q96S37 18/20 0.37
▸ SLC22A6 Q4U2R8 1/20 0.35
▸ SLC22A11 Q9NSA0 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
SCHEMBL28856560 0.84 ALDH1A1 (0.33) PPARASLC22A12
SCHEMBL28856538 0.84 SLC22A12 (0.53) PPARASLC22A12SLC22A6SLC22A11
SCHEMBL28856513 0.82 SLC22A12 (0.54) PPARASLC22A12SLC22A6SLC22A11
SCHEMBL28856492 0.81 PPARA (0.48) PPARASLC22A12SLC22A6SLC22A11
SCHEMBL28856528 0.80 SLC22A12 (0.57) PPARASLC22A12SLC22A6SLC22A11
SCHEMBL28856558 0.79 SLC22A12 (0.49) PPARASLC22A12SLC22A6SLC22A11
SCHEMBL28856531 0.77 SLC22A12 (0.58) PPARASLC22A12SLC22A6SLC22A11
SCHEMBL28856551 0.74 SLC22A12 (0.31) SLC22A12
SCHEMBL28856519 0.69 SLC22A12 (0.38) PPARASLC22A12
SCHEMBL10176720 0.65 SLC22A12 (0.43) SLC22A12

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-109608432-B Thiophene derivatives as URAT1 inhibitors 江苏艾立康医药科技有限公司 2022-10-11 — — CN disclosed
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