SCHEMBL4645694

SCHEMBL4645694

O=C(CO)C(=O)C(Cl)(Cl)Cl

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OR51E2 Q9H255 1/20 0.40
ALDH1A1 P00352 1/20 0.37
TP53 P04637 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL4644047 0.77 ALDH1A1 (0.33) ALDH1A1TP53TSHR
SCHEMBL4644070 0.75 TSHR (0.37) ALDH1A1TP53TSHR
SCHEMBL7947984 0.73 FFAR3 (0.35) ALDH1A1TP53TSHR
SCHEMBL4643614 0.73 CAMK2A (0.42) ALDH1A1TP53TSHR
SCHEMBL6282434 0.71 ALDH1A1 (0.54) ALDH1A1TP53TSHR
SCHEMBL4642319 0.71 GPR84 (0.42)
SCHEMBL4644088 0.71 ALDH1A1 (0.33) ALDH1A1TP53TSHR
SCHEMBL10977744 0.69 CES1 (0.55) ALDH1A1TP53TSHR
SCHEMBL4643993 0.69 OR51E2 (0.40) OR51E2ALDH1A1
SCHEMBL4645419 0.69 OR51E2 (0.40) OR51E2

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