SCHEMBL4647741

SCHEMBL4647741

[CH2]CC(=O)Oc1cccc(O)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.59
ESR1 P03372 2/20 0.49
ESR2 Q92731 2/20 0.49
POLB P06746 1/20 0.49
ACHE P22303 1/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
LMNA P02545 2/20 0.42
APP P05067 1/20 0.41
CHRNB2 P17787 1/20 0.41
CHRNA4 P43681 1/20 0.41
EGFR P00533 1/20 0.41
CA12 O43570 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CA2 P00918 1/20 0.39
CA5A P35218 1/20 0.39
CA9 Q16790 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CA14 Q9ULX7 1/20 0.39
CA5B Q9Y2D0 1/20 0.39

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
SCHEMBL4643939 0.86 CYP3A4 (0.56) CYP3A4ESR1ESR2POLBACHE
SCHEMBL689199 0.85 CYP3A4 (0.63) CYP3A4ESR1ESR2POLBACHE
SCHEMBL689449 0.85 CYP3A4 (0.63) CYP3A4ESR1ESR2POLBACHE
SCHEMBL4644822 0.84 CYP3A4 (0.54) CYP3A4ESR1ESR2POLBKMT2A
SCHEMBL4642390 0.83 CYP3A4 (0.61) CYP3A4ESR1ESR2POLBACHE
SCHEMBL29995062 0.81 CYP3A4 (0.65) CYP3A4ESR1ESR2POLBACHE
SCHEMBL4644019 0.81 CYP3A4 (0.59) CYP3A4ESR1ESR2POLBACHE
SCHEMBL689823 0.81 CYP3A4 (0.59) CYP3A4ESR1ESR2POLBKMT2A
SCHEMBL3905574 0.81 CYP3A4 (0.65) CYP3A4ESR1ESR2POLBACHE
SCHEMBL4633863 0.81 CYP3A4 (0.59) CYP3A4ESR1ESR2POLBACHE

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