SCHEMBL2622701

SCHEMBL2622701

C=C(C)C(=O)OCCCOC(=O)C(C)CC

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.58
THRB P10828 1/20 0.50
POLB P06746 1/20 0.41
APEX1 P27695 1/20 0.41
HTT P42858 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ALDH1A1 P00352 3/20 0.36
HPGD P15428 1/20 0.32
ACHE P22303 1/20 0.30
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 1/20 0.30

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
SCHEMBL12793081 0.96 TSHR (0.62) TSHRTHRBPOLBAPEX1HTT
SCHEMBL4544635 0.93 THRB (0.58) TSHRTHRBPOLBAPEX1HTT
SCHEMBL26038191 0.88 THRB (0.62) TSHRTHRBPOLBAPEX1HTT
SCHEMBL26038157 0.88 THRB (0.62) TSHRTHRBPOLBAPEX1HTT
SCHEMBL12755488 0.88 THRB (0.62) TSHRTHRBPOLBAPEX1HTT
SCHEMBL17790730 0.87 TSHR (0.45) TSHRTHRBACHE
SCHEMBL25501848 0.85 TSHR (0.54) TSHRTHRBPOLBAPEX1HTT
SCHEMBL12392172 0.85 THRB (0.50) TSHRTHRBPOLBAPEX1HTT
SCHEMBL16689113 0.84 TSHR (0.49) TSHRTHRBACHE
SCHEMBL25784296 0.83 THRB (0.49) TSHRTHRBPOLBAPEX1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160361914-A1 METHOD FOR PROCESSING ON-PRESS DEVELOPMENT-TYPE LITHOGRAPHIC PRINTING PLATE PRECURSOR AND PRINTING METHOD FUJIFILM CORPORATION (JP) 2016-12-15 US disclosed
US-8163447-B2 Dispersion resin having unsaturation modifier, pigments, photoinitiator and polypentaerythritol polyacrylate compound; tinctorial strength, storage stability, alkali developability; suppressing generation of residues between pixels FUJIFILM CORPORATION (JP) 2012-04-24 US disclosed
US-20080241713-A1 COLORED PHOTOCURABLE COMPOSITION FOR SOLID STATE IMAGE PICK-UP DEVICE, COLOR FILTER AND METHOD FOR PRODUCTION THEREOF, AND SOLID STATE IMAGE PICK-UP DEVICE FUJIFILM CORPORATION (JP) 2008-10-02 US disclosed