SCHEMBL14733971

SCHEMBL14733971

COCCSc1ccc(C)cc1SCCOC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.44
MAP2K7 O14733 1/20 0.40
CDC25A P30304 1/20 0.40
CDC25B P30305 1/20 0.40
HSD17B10 Q99714 5/20 0.38
ALDH1A1 P00352 4/20 0.38
ALOX15 P16050 3/20 0.38
HPGD P15428 3/20 0.38
KDM4E B2RXH2 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
KMT2A Q03164 3/20 0.37
NPC1 O15118 3/20 0.37
RAB9A P51151 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
NFKB1 P19838 1/20 0.37
NFKB2 Q00653 1/20 0.37
RELA Q04206 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ALOX12 P18054 2/20 0.36
PRKAG1 P54619 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
SCHEMBL9515893 0.78 HPGD (0.39) HSD17B10ALDH1A1ALOX15HPGDKDM4E
SCHEMBL14734012 0.77 HSD17B10 (0.53) PKMMAP2K7CDC25ACDC25BHSD17B10
SCHEMBL14734011 0.76 HSD17B10 (0.42) MAP2K7CDC25ACDC25BHSD17B10ALDH1A1
SCHEMBL12203984 0.75 KDM4E (0.53) PKMMAP2K7CDC25ACDC25BALDH1A1
Ammonia Solution, Strong SCHEMBL27828064 0.69 PKM (0.48) PKMMAP2K7CDC25ACDC25BHSD17B10
SCHEMBL9515924 0.69 LMNA (0.45) PKMHSD17B10ALDH1A1ALOX15HPGD
SCHEMBL30753704 0.69 L3MBTL1 (0.46) HSD17B10ALDH1A1ALOX15HPGDKDM4E
SCHEMBL12069928 0.68 ALDH1A1 (0.44) PKMMAP2K7CDC25ACDC25BHSD17B10
SCHEMBL11599090 0.67 L3MBTL1 (0.34) ALDH1A1HPGDTDP1KMT2ANPC1
SCHEMBL7620846 0.67 KMT2A (0.48) PKMMAP2K7CDC25ACDC25BHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2748143-B1 MONOMERIC AND OLIGOMERIC UNSATURATED VICINAL DITHIOETHERS AND THEIR USE FOR SELECTIVE PALLADIUM (II) SEPARATION FROM SECONDARY RAW MATERIALS UNIVERSITÄT POTSDAM (DE) 2017-08-16 EP claimed
EP-2748143-B1 MONOMERIC AND OLIGOMERIC UNSATURATED VICINAL DITHIOETHERS AND THEIR USE FOR SELECTIVE PALLADIUM (II) SEPARATION FROM SECONDARY RAW MATERIALS UNIVERSITÄT POTSDAM (DE) 2017-08-16 EP disclosed
EP-2748143-B1 MONOMERIC AND OLIGOMERIC UNSATURATED VICINAL DITHIOETHERS AND THEIR USE FOR SELECTIVE PALLADIUM (II) SEPARATION FROM SECONDARY RAW MATERIALS UNIVERSITÄT POTSDAM (DE) 2017-08-16 EP disclosed
WO-2013026885-A1 MONOMERIC AND OLIGOMERIC UNSATURATED VICINAL DITHIOETHERS AND THEIR USE FOR SELECTIVE PALLADIUM (II) SEPARATION FROM SECONDARY RAW MATERIALS UNIVERSITÄT POTSDAM (DE) 2013-02-28 WO disclosed