SCHEMBL28856538

SCHEMBL28856538

Cc1ccc(-c2ccc(SC(C)(C)C(=O)O)s2)c2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SLC22A12 Q96S37 15/20 0.53
▸ PPARA Q07869 1/20 0.50
▸ HPGD P15428 2/20 0.38
▸ SLC22A6 Q4U2R8 1/20 0.37
▸ SLC22A11 Q9NSA0 1/20 0.37
▸ CYP1A2 P05177 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ MAPK1 P28482 1/20 0.34

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
SCHEMBL28856513 0.86 SLC22A12 (0.54) SLC22A12PPARASLC22A6SLC22A11CYP1A2
SCHEMBL28856492 0.85 PPARA (0.48) SLC22A12PPARASLC22A6SLC22A11CYP1A2
SCHEMBL28856519 0.84 SLC22A12 (0.38) SLC22A12PPARAHPGDALDH1A1LMNA
SCHEMBL28856548 0.84 PPARA (0.47) SLC22A12PPARASLC22A6SLC22A11
SCHEMBL28856528 0.83 SLC22A12 (0.57) SLC22A12PPARASLC22A6SLC22A11
SCHEMBL28856558 0.82 SLC22A12 (0.49) SLC22A12PPARASLC22A6SLC22A11CYP1A2
SCHEMBL28856531 0.80 SLC22A12 (0.58) SLC22A12PPARASLC22A6SLC22A11MAPT
SCHEMBL28856529 0.73 TP53 (0.33) SLC22A12PPARAHPGDALDH1A1MAPT
SCHEMBL28856520 0.72 SLC22A12 (0.39) SLC22A12PPARAHPGDCYP1A2ALDH1A1
SCHEMBL28856510 0.72 PPARA (0.43) SLC22A12PPARA

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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