SCHEMBL28782818

SCHEMBL28782818

O=C1CCC(=O)OCCOCCCCO1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.64
CA9 Q16790 1/20 0.64
LMNA P02545 3/20 0.48
ALDH1A1 P00352 2/20 0.48
TSHR P16473 2/20 0.48
TP53 P04637 1/20 0.48
CRHBP P24387 2/20 0.32
CRHR2 Q13324 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
HTT P42858 1/20 0.32
TTR P02766 1/20 0.30
GAA P10253 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
SCHEMBL28344507 0.89 CA1 (0.78) CA1CA9LMNAALDH1A1TSHR
SCHEMBL8060202 0.89 LMNA (0.59) CA1CA9LMNAALDH1A1TSHR
SCHEMBL11997762 0.89 LMNA (0.59) CA1CA9LMNAALDH1A1TSHR
Tetrahydrofuran SCHEMBL7762875 0.88 CA1 (0.76) CA1CA9LMNAALDH1A1TSHR
SCHEMBL11213660 0.88 CA1 (0.68) CA1CA9LMNAALDH1A1TSHR
SCHEMBL11666040 0.88 CA1 (0.68) CA1CA9LMNAALDH1A1TSHR
SCHEMBL11220304 0.88 CA1 (0.68) CA1CA9LMNAALDH1A1TSHR
Butyrolactone SCHEMBL2301549 0.87 CA1 (0.75) CA1CA9LMNAALDH1A1TSHR
Tetrahydrofuran SCHEMBL28748839 0.87 CA1 (0.84) CA1CA9LMNAALDH1A1TSHR
SCHEMBL45714 0.87 CA1 (0.82) CA1CA9LMNAALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101471453-B Colloidal polymer electrolyte precursor composition and secondary battery comprising same IND TECH RES INST 2010-12-08 CN claimed
CN-101471453-A Colloidal polymer electrolyte precursor composition and secondary battery comprising same IND TECH RES INST (CN) 2009-07-01 CN claimed
CN-102317064-A Metal-polymer bonding using epoxy-based adhesives HENKEL AG & CO KGAA 2012-01-11 CN disclosed
CN-101471453-B Colloidal polymer electrolyte precursor composition and secondary battery comprising same IND TECH RES INST 2010-12-08 CN disclosed
CN-101471453-A Colloidal polymer electrolyte precursor composition and secondary battery comprising same IND TECH RES INST (CN) 2009-07-01 CN disclosed