SCHEMBL1104189

SCHEMBL1104189

CCOC(=O)c1ccc(OC(=O)C(C)(C)CC)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.57
CA1 P00915 2/20 0.57
CA2 P00918 2/20 0.57
CA7 P43166 2/20 0.57
CA9 Q16790 2/20 0.57
CA14 Q9ULX7 2/20 0.57
ESR1 P03372 1/20 0.57
ESR2 Q92731 1/20 0.57
ELANE P08246 3/20 0.55
CYP1A2 P05177 2/20 0.51
LMNA P02545 2/20 0.51
CYP3A4 P08684 1/20 0.51
MAOA P21397 1/20 0.51
STS P08842 1/20 0.51
PRSS1 P07477 1/20 0.51
ACR P10323 1/20 0.51
PRTN3 P24158 1/20 0.50
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
TSHR P16473 1/20 0.49

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
SCHEMBL7706011 0.87 ELANE (0.64) CA12CA1CA2CA7CA9
SCHEMBL1104226 0.86 ELANE (0.56) CA12CA1CA2CA7CA9
SCHEMBL28245976 0.86 ELANE (0.62) CA12CA1CA2CA7CA9
SCHEMBL14649722 0.85 ELANE (0.54) CA12CA1CA2CA7CA9
SCHEMBL10064124 0.84 ELANE (0.55) CA12CA1CA2CA9CA14
SCHEMBL2734973 0.84 ELANE (0.49) CA12CA1CA2CA7CA9
SCHEMBL825366 0.83 MAPT (0.56) ELANEPRSS1ACRMEN1KMT2A
SCHEMBL14827406 0.83 ELANE (0.54) ESR1ELANECYP1A2PRTN3KMT2A
SCHEMBL17853786 0.82 ELANE (0.47) CA12CA1CA2CA7CA9
SCHEMBL11964033 0.82 ELANE (0.59) CA1CA2ELANETSHRTP53

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-8151705-B2 Method of preparing lithographic printing plate FUJIFILM CORPORATION (JP) 2012-04-10 US disclosed
US-20100081771-A1 METHOD OF PREPARING LITHOGRAPHIC PRINTING PLATE FUJIFILM CORPORATION (JP) 2010-04-01 US disclosed
US-7507525-B2 Polymerizable composition and lithographic printing plate precursor FUJIFILM CORPORATION (JP) 2009-03-24 US disclosed
US-7279539-B2 Alkali-soluble polymer and polymerizable composition thereof FUJIFILM CORPORATION (JP) 2007-10-09 US disclosed