SCHEMBL4645633

SCHEMBL4645633

O=Cc1cccc(O)c1OC(=O)CCCCl

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
ERN1 O75460 4/20 0.41
TRIM24 O15164 1/20 0.40
TRIM33 Q9UPN9 1/20 0.40
KMT2A Q03164 2/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.38
ALDH1A1 P00352 2/20 0.37
HPGD P15428 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
IAPP P10997 2/20 0.34
TLR2 O60603 1/20 0.33
TLR1 Q15399 1/20 0.33
TLR6 Q9Y2C9 1/20 0.33
BACE1 P56817 1/20 0.33
SRC P12931 1/20 0.32
MEN1 O00255 1/20 0.32
RAD52 P43351 1/20 0.32

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
SCHEMBL4641869 0.96 CA1 (0.49) CA1CA2ERN1TRIM24TRIM33
SCHEMBL4642637 0.91 CA1 (0.53) CA1CA2ERN1TRIM24TRIM33
SCHEMBL4642116 0.87 CA1 (0.51) CA1CA2ERN1TRIM24TRIM33
SCHEMBL4646698 0.86 CA1 (0.50) CA1CA2ERN1TRIM24TRIM33
SCHEMBL4643529 0.86 CA1 (0.50) CA1CA2ERN1TRIM24TRIM33
SCHEMBL4642684 0.84 ERN1 (0.41) CA1CA2ERN1KMT2APTGDR2
SCHEMBL4642514 0.84 CA1 (0.54) CA1CA2ERN1TRIM24TRIM33
SCHEMBL4642398 0.82 CA1 (0.53) CA1CA2ERN1TRIM24TRIM33
SCHEMBL4647655 0.82 SRC (0.50) CA1CA2ERN1KMT2APTGDR2
SCHEMBL4645983 0.81 MEN1 (0.44) CA1CA2ERN1KMT2APTGDR2

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