SCHEMBL28095095

SCHEMBL28095095

C=C(C)C(=O)OCCC1CCC(OCC)CC1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.49
TSHR P16473 3/20 0.44
ALDH1A1 P00352 2/20 0.39
POLB P06746 1/20 0.32
APEX1 P27695 1/20 0.32
HTT P42858 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
NAAA Q02083 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
SCHEMBL2782247 0.88 THRB (0.50) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL19844232 0.83 THRB (0.46) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL19844221 0.83 THRB (0.46) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL1973419 0.82 THRB (0.44) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL9979756 0.82 THRB (0.42) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL23494221 0.82 THRB (0.47) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL19844228 0.81 THRB (0.41) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL3449181 0.81 THRB (0.41) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL16874410 0.80 THRB (0.46) THRBTSHRALDH1A1NAAA
SCHEMBL22567313 0.80 THRB (0.46) THRBTSHRALDH1A1NAAA

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
CN-103226289-B Colorant, coloured composition, colour filter and display element JSR株式会社 2019-07-09 CN disclosed
CN-106933033-A Photosensitive resin composition, color filter and manufacturing method thereof, and liquid crystal display device 奇美实业股份有限公司 2017-07-07 CN disclosed
CN-106019835-A Photosensitive resin composition for color filter and application thereof 奇美实业股份有限公司 2016-10-12 CN disclosed