SCHEMBL1476093

SCHEMBL1476093

CCc1cccc(-c2nccs2)c1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 6/20 0.46
ADORA1 P30542 6/20 0.46
ADORA3 P0DMS8 4/20 0.46
ADORA2B P29275 3/20 0.46
PDPK1 O15530 1/20 0.41
LOXL2 Q9Y4K0 1/20 0.40
PORCN Q9H237 1/20 0.39
LMNA P02545 2/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HCRTR1 O43613 1/20 0.38
HCRTR2 O43614 1/20 0.38
ADRA1D P25100 1/20 0.37
ADRA1A P35348 1/20 0.37
ADRA1B P35368 1/20 0.37
ADRB2 P07550 1/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.37
CASP6 P55212 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
SCHEMBL8624878 0.85 PDPK1 (0.48) ADORA2AADORA1ADORA3ADORA2BPDPK1
SCHEMBL6933784 0.83 PDPK1 (0.40) ADORA2AADORA1ADORA3ADORA2BPDPK1
SCHEMBL18415038 0.80 TUBB4A (0.40) ADORA2AADORA1ADORA3ADORA2BPDPK1
SCHEMBL11211014 0.80 PDPK1 (0.46) ADORA2AADORA1PDPK1LOXL2ADRA1D
SCHEMBL10336938 0.77 CTSA (0.45) ADORA2AADORA1PDPK1LOXL2ALDH1A1
SCHEMBL24359761 0.75 ADORA2A (0.46) ADORA2AADORA1LMNAALDH1A1HPGD
SCHEMBL11398268 0.75 PDPK1 (0.46) ADORA2AADORA1ADORA3ADORA2BPDPK1
SCHEMBL2041112 0.75 CYP1A2 (0.44) PDPK1ALDH1A1HPGDSMN1; SMN2HCRTR1
SCHEMBL1048706 0.75 ADORA2A (0.40) ADORA2AADORA1ADORA3ADORA2BHPGD
SCHEMBL17194980 0.74 ADORA2A (0.42) ADORA2AADORA1PDPK1LOXL2ADRA1D

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-7914966-B2 Modified polymers and their use in the production of lithographic printing plate precursors EASTMAN KODAK COMPANY (US) 2011-03-29 US disclosed
US-20070269727-A1 Modified Polymers and Their Use in the Production of Lithographic Printing Plate Precursors KODAK POLYCHROME GRAPHICS GMBH (DE) 2007-11-22 US disclosed
EP-1761397-A1 MODIFIED POLYMERS AND THEIR USE IN THE PRODUCTION OF LITHOGRAPHIC PRINTING PLATE PRECURSORS Kodak Polychrome Graphics GmbH (DE) 2007-03-14 EP disclosed
WO-2005123412-A1 MODIFIED POLYMERS AND THEIR USE IN THE PRODUCTION OF LITHOGRAPHIC PRINTING PLATE PRECURSORS KODAK POLYCHROME GRAPHICS GMBH (DE) 2005-12-29 WO disclosed