SCHEMBL4644094

SCHEMBL4644094

[CH2]C(=O)Oc1ccc(OC)cc1OC

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.61
CA1 P00915 1/20 0.61
CA2 P00918 1/20 0.61
CA7 P43166 1/20 0.61
CA9 Q16790 1/20 0.61
CA14 Q9ULX7 1/20 0.61
KMT2A Q03164 3/20 0.51
ALDH1A1 P00352 4/20 0.50
HTT P42858 2/20 0.50
MAPT P10636 2/20 0.50
GAA P10253 2/20 0.50
NPSR1 Q6W5P4 1/20 0.50
LMNA P02545 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
HSD17B10 Q99714 1/20 0.49
NPC1 O15118 1/20 0.49
MEN1 O00255 1/20 0.47
JUN P05412 1/20 0.47
NFKB1 P19838 1/20 0.47
ABCG2 Q9UNQ0 1/20 0.47

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
SCHEMBL9669664 0.83 CA12 (0.63) CA12CA1CA2CA7CA9
SCHEMBL9669672 0.83 CA12 (0.63) CA12CA1CA2CA7CA9
SCHEMBL3328971 0.83 TSHR (0.64) CA12CA1CA2CA7CA9
SCHEMBL4644023 0.82 ALDH1A1 (0.43) CA12CA1CA2CA7CA9
SCHEMBL14734821 0.81 CA12 (0.67) CA12CA1CA2CA7CA9
SCHEMBL10962426 0.81 CA12 (0.61) CA12CA1CA2CA7CA9
SCHEMBL4645740 0.81 CA12 (0.55) CA12CA1CA2CA7CA9
SCHEMBL4644515 0.80 ALDH1A1 (0.57) KMT2AALDH1A1MAPTLMNAMEN1
SCHEMBL4645734 0.79 CA12 (0.57) CA12CA1CA2CA7CA9
SCHEMBL4644084 0.79 CA12 (0.57) CA12CA1CA2CA7CA9

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