SCHEMBL4643529

SCHEMBL4643529

[CH2]CCCC(=O)Oc1c(O)cccc1C=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
KMT2A Q03164 1/20 0.42
ERN1 O75460 3/20 0.41
TRIM24 O15164 1/20 0.40
TRIM33 Q9UPN9 1/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.35
IAPP P10997 3/20 0.34
TLR2 O60603 1/20 0.33
TLR1 Q15399 1/20 0.33
TLR6 Q9Y2C9 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PRSS1 P07477 1/20 0.33
PRSS2 P07478 1/20 0.33
PRSS3 P35030 1/20 0.33
SRC P12931 1/20 0.32
CYP19A1 P11511 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
SCHEMBL4642398 0.91 CA1 (0.53) CA1CA2KMT2AERN1TRIM24
SCHEMBL4642116 0.87 CA1 (0.51) CA1CA2KMT2AERN1TRIM24
SCHEMBL4645633 0.86 CA1 (0.50) CA1CA2KMT2AERN1TRIM24
SCHEMBL4646698 0.86 CA1 (0.50) CA1CA2KMT2AERN1TRIM24
SCHEMBL4644800 0.85 CA1 (0.56) CA1CA2KMT2AERN1TRIM24
SCHEMBL4641667 0.84 ERN1 (0.41) CA1CA2KMT2AERN1PTGDR2
SCHEMBL4641869 0.84 CA1 (0.49) CA1CA2KMT2AERN1TRIM24
SCHEMBL4642514 0.84 CA1 (0.54) CA1CA2KMT2AERN1TRIM24
SCHEMBL4642637 0.82 CA1 (0.53) CA1CA2KMT2AERN1TRIM24
SCHEMBL4643841 0.82 SRC (0.50) CA1CA2KMT2AERN1PTGDR2

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
EP-1487928-B1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2008-08-13 EP disclosed
EP-1487928-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT Jotun AS (NO) 2004-12-22 EP disclosed
WO-2003080747-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2003-10-02 WO disclosed