SCHEMBL10050692

SCHEMBL10050692

CC(C)c1ccc2sc3c(O)ccc(O)c3c(=O)c2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RNASEH1 O60930 1/20 0.44
PIM1 P11309 1/20 0.41
PIM2 Q9P1W9 1/20 0.41
TYR P14679 3/20 0.40
ALDH1A1 P00352 4/20 0.39
ALOX12 P18054 2/20 0.39
HTT P42858 2/20 0.39
GAA P10253 2/20 0.39
HIF1A Q16665 1/20 0.39
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
MAPT P10636 3/20 0.37
KDM4E B2RXH2 1/20 0.37
MDM4 O15151 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
TP53 P04637 1/20 0.37
CYP3A4 P08684 1/20 0.37
HPGD P15428 1/20 0.37
ALOX15 P16050 1/20 0.37

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
SCHEMBL10050666 0.75 NPC1 (0.44) PIM1PIM2ALDH1A1HTTGAA
SCHEMBL5218956 0.73 MAOA (0.57) ALDH1A1HTTGAAHIF1AMAOA
SCHEMBL2705508 0.72 KDM4E (0.44) RNASEH1PIM1PIM2ALDH1A1MAOA
SCHEMBL30612323 0.71 KDM4E (0.58) PIM1PIM2ALDH1A1GAAMAOA
SCHEMBL41594 0.71 KDM4E (0.58) PIM1PIM2ALDH1A1GAAMAOA
SCHEMBL29353401 0.71 KDM4E (0.58) PIM1PIM2ALDH1A1GAAMAOA
SCHEMBL13522721 0.70 NPC1 (0.44) RNASEH1PIM1PIM2TYRALDH1A1
Hydrogen Sulfide SCHEMBL28826265 0.70 KDM4E (0.57) PIM1PIM2ALDH1A1GAAMAOA
Ammonia Solution, Strong SCHEMBL29287857 0.70 KDM4E (0.57) PIM1PIM2ALDH1A1GAAMAOA
SCHEMBL28244933 0.70 KDM4E (0.57) PIM1PIM2ALDH1A1GAAMAOA

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
US-8097688-B2 Ink composition and inkjet recording method FUJIFILM CORPORATION (JP) 2012-01-17 US disclosed
US-8097688-B2 Ink composition and inkjet recording method FUJIFILM CORPORATION (JP) 2012-01-17 US disclosed
US-20100227076-A1 INK COMPOSITION AND INKJET RECORDING METHOD FUJIFILM CORPORATION (JP) 2010-09-09 US disclosed
US-20100227076-A1 INK COMPOSITION AND INKJET RECORDING METHOD FUJIFILM CORPORATION (JP) 2010-09-09 US disclosed