SCHEMBL13573469

SCHEMBL13573469

CCC(C)(C)c1ccc(S(=O)(=O)c2ccc(Oc3ccc(O)cc3S(=O)(=O)O)c(S(=O)(=O)O)c2)cc1S(=O)(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ HPGD P15428 1/20 0.39
▸ HIF1A Q16665 1/20 0.39
▸ GAA P10253 4/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ PKM P14618 2/20 0.36
▸ ELANE P08246 2/20 0.34
▸ POLB P06746 4/20 0.33
▸ MAPK1 P28482 2/20 0.33
▸ TSHR P16473 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ CASP1 P29466 1/20 0.31
▸ GFER P55789 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ ALOX15 P16050 1/20 0.30

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
SCHEMBL13605241 0.85 LMNA (0.35) LMNAHSD17B10HPGDHIF1AGAA
SCHEMBL14546136 0.84 CASP1 (0.36) HSD17B10ALDH1A1PKMPOLBMAPK1
SCHEMBL13181479 0.83 CASP1 (0.35) HSD17B10ALDH1A1PKMELANEPOLB
SCHEMBL19359711 0.82 MEN1 (0.35) ALDH1A1MAPK1MEN1KMT2ASMN1; SMN2
SCHEMBL14520413 0.82 MEN1 (0.36) LMNAHSD17B10HPGDHIF1AGAA
SCHEMBL14546134 0.80 CASP1 (0.34) HSD17B10ALDH1A1PKMPOLBMAPK1
SCHEMBL13181447 0.80 HDAC1 (0.33) ALDH1A1ELANEPOLBMAPK1TSHR
SCHEMBL12807621 0.79 RRM1 (0.34) HSD17B10ALDH1A1PKMPOLBMAPK1
SCHEMBL13181442 0.78 ELANE (0.39) LMNAGAAALDH1A1PKMELANE
SCHEMBL13181464 0.77 MAPT (0.34) HSD17B10ALDH1A1PKMELANEPOLB

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-20090317683-A1 MEMBRANE ELECTRODE ASSEMBLY FOR FUEL CELL AND FUEL CELL TOYOTA JIDOSHA KABUSHIKI KAISHA (JP) 2009-12-24 — — US disclosed
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