SCHEMBL4642392

SCHEMBL4642392

COC(=O)C=CC(=O)OC(C(=O)OC(C)=O)C(=O)c1ccc(OC)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.40
ALDH1A1 P00352 2/20 0.40
LMNA P02545 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CYP1A2 P05177 1/20 0.40
CA1 P00915 6/20 0.40
CA2 P00918 6/20 0.40
CA12 O43570 2/20 0.38
CA9 Q16790 2/20 0.38
CES2 O00748 1/20 0.38
CES1 P23141 1/20 0.38
PLK1 P53350 1/20 0.38
MAPT P10636 2/20 0.38
POLB P06746 1/20 0.38
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
F3 P13726 1/20 0.38

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
SCHEMBL4644973 0.89 CA12 (0.41) SLC2A1ALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL4645080 0.87 ALDH1A1 (0.42) ALDH1A1HTTCA1CA2CA12
SCHEMBL4642383 0.79 KLK7 (0.40) ALDH1A1LMNAMAPTPOLBMEN1
SCHEMBL4646915 0.79 KLK7 (0.40) ALDH1A1LMNAMAPTPOLBMEN1
SCHEMBL4645346 0.74 MAPT (0.46) ALDH1A1LMNACA1CA2CA12
SCHEMBL4641605 0.73 HCAR2 (0.43) ALDH1A1LMNAHTTMAPTRAB9A
SCHEMBL4643250 0.72 ALDH1A1 (0.40) ALDH1A1HTTMAPTPOLBMEN1
SCHEMBL10938616 0.71 F3 (0.64) ALDH1A1LMNASMN1; SMN2CA1CA2
SCHEMBL10938612 0.71 F3 (0.64) ALDH1A1LMNASMN1; SMN2CA1CA2
SCHEMBL4642296 0.71 HCAR2 (0.41) ALDH1A1LMNAHTTMAPTRAB9A

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