SCHEMBL8013796

SCHEMBL8013796

C=CC(=O)OC[C@H]1OC(OCC)[C@H](O)[C@@H](O)[C@H]1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TLR4 O00206 1/20 0.41
▸ PRKCA P17252 2/20 0.40
▸ PRKD3 O94806 1/20 0.40
▸ PRKCG P05129 1/20 0.40
▸ PRKCB P05771 1/20 0.40
▸ PRKCH P24723 1/20 0.40
▸ PRKCI P41743 1/20 0.40
▸ PRKCE Q02156 1/20 0.40
▸ PRKCQ Q04759 1/20 0.40
▸ PRKCZ Q05513 1/20 0.40
▸ PRKCD Q05655 1/20 0.40
▸ PRKD1 Q15139 1/20 0.40
▸ CYP19A1 P11511 1/20 0.40
▸ CA1 P00915 3/20 0.40
▸ CA2 P00918 3/20 0.40
▸ CA9 Q16790 3/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ IGF2R P11717 5/20 0.38
▸ HPGD P15428 1/20 0.36
▸ TSHR P16473 1/20 0.36

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
SCHEMBL8014983 1.00 TLR4 (0.41) TLR4PRKCAPRKD3PRKCGPRKCB
SCHEMBL2964015 0.85 PRKCA (0.42) TLR4PRKCAPRKD3PRKCGPRKCB
SCHEMBL2964018 0.85 PRKCA (0.42) TLR4PRKCAPRKD3PRKCGPRKCB
SCHEMBL29564847 0.85 PRKCA (0.42) TLR4PRKCAPRKD3PRKCGPRKCB
SCHEMBL16078202 0.85 TLR4 (0.47) TLR4PRKCAPRKD3PRKCGPRKCB
SCHEMBL16081494 0.79 TLR4 (0.43) TLR4PRKCAPRKD3PRKCGPRKCB
SCHEMBL24621714 0.79 SLC2A1 (0.38) TLR4PRKCAPRKD3PRKCGPRKCB
SCHEMBL10233847 0.79 SLC2A1 (0.38) TLR4PRKCAPRKD3PRKCGPRKCB
SCHEMBL19779374 0.79 FBP1 (0.38) TLR4PRKCAPRKD3PRKCGPRKCB
SCHEMBL24629824 0.79 SLC2A1 (0.38) TLR4PRKCAPRKD3PRKCGPRKCB

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
WO-2000040662-A1 COATING COMPOSITIONS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 2000-07-13 — — WO disclosed
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