SCHEMBL28095164

SCHEMBL28095164

C=CC(=O)C(O)COC(=O)C1CCCCC1(C)C(=O)OCC(O)C(=O)C=C

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.33
ADRB1 P08588 1/20 0.33
ADRB3 P13945 1/20 0.33
NR1H2 P55055 1/20 0.30
NR1H3 Q13133 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
SCHEMBL28094967 0.89 POLB (0.32) ADRB2ADRB1ADRB3
SCHEMBL11221438 0.79 CYP3A4 (0.32) ADRB2ADRB1ADRB3
SCHEMBL28408014 0.78 MAPT (0.32)
SCHEMBL28144958 0.77 TSHR (0.39) NR1H2NR1H3
SCHEMBL29073203 0.75 TSHR (0.41) NR1H2NR1H3
SCHEMBL21950906 0.74 F10 (0.41)
SCHEMBL27459985 0.73 ALDH1A1 (0.34)
SCHEMBL27652585 0.73 F10 (0.36) NR1H2NR1H3
SCHEMBL5063143 0.73 TP53 (0.42) ADRB2ADRB1ADRB3
SCHEMBL27938509 0.72 F10 (0.36) NR1H2NR1H3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103582657-B Metal-containing copolymer, process for producing the same, composition for antifouling paint, and article having coating film of the antifouling paint 三菱丽阳株式会社 2016-08-17 CN disclosed