SCHEMBL172177

SCHEMBL172177

C[N+](C)(C)C(CO)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
OR51E2 Q9H255 1/20 0.39
ALPL P05186 1/20 0.38
POLB P06746 1/20 0.38
ALPG P10696 1/20 0.38
GABRR1 P24046 2/20 0.33
TSHR P16473 1/20 0.33
PDE4A P27815 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
APEX1 P27695 1/20 0.32
TP53 P04637 1/20 0.32
TGFBR1 P36897 2/20 0.31
ALOX15 P16050 1/20 0.31
MAPT P10636 1/20 0.31
SLC1A1 P43005 1/20 0.31

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
SCHEMBL7505468 1.00 OR51E2 (0.39) OR51E2ALPLPOLBALPGGABRR1
SCHEMBL14744262 0.79 GABRR1 (0.36) OR51E2ALPLPOLBALPGGABRR1
SCHEMBL22479145 0.79 GABRR1 (0.36) OR51E2ALPLPOLBALPGGABRR1
SCHEMBL6743070 0.79 OR51E2 (0.36) OR51E2GABRR1TSHRPDE4ATGFBR1
SCHEMBL527749 0.78 ALPL (0.33) ALPLPOLBALPGTSHRALOX15
SCHEMBL3681360 0.78 ALPL (0.38) ALPLPOLBALPGGABRR1TSHR
SCHEMBL28224456 0.76 MAPT (0.44) ALPLPOLBALPGGABRR1TSHR
SCHEMBL18121359 0.76 PTGS1 (0.40) ALPLPOLBALPGALOX15MAPT
Hydrochloric Acid SCHEMBL6045267 0.76 ALPL (0.36) ALPLPOLBALPGGABRR1TSHR
Acetic Acid SCHEMBL3682289 0.74 ALPL (0.35) ALPLPOLBALPGGABRR1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8304171-B2 Plate making method of lithographic printing plate precursor FUJIFILM CORPORATION (JP) 2012-11-06 US disclosed
EP-2082875-B1 Lithographic printing plate precursor and plate making method using the precursor FUJIFILM CORP (JP) 2012-03-07 EP disclosed
EP-2236292-A2 Lithographic printing plate precursor and plate making method thereof FUJIFILM Corporation (JP) 2010-10-06 EP disclosed
US-20100248142-A1 LITHOGRAPHIC PRINTING PLATE PRECURSOR AND PLATE MAKING METHOD THEREOF FUJIFILM CORPORATION (JP) 2010-09-30 US disclosed
US-20100075260-A1 PLATE MAKING METHOD OF LITHOGRAPHIC PRINTING PLATE PRECURSOR FUJIFILM CORPORATION (JP) 2010-03-25 US disclosed
US-20100055607-A1 LITHOGRAPHIC PRINTING PLATE PRECURSOR AND PLATE MAKING METHOD THEREOF FUJIFILM CORPORATION (JP) 2010-03-04 US disclosed
US-20090233222-A1 LITHOGRAPHIC PRINTING PLATE PRECURSOR FUJIFILM CORPORATION (JP) 2009-09-17 US disclosed