(E)-7-(2-Butenyloxy)Coumarin

(E)-7-(2-Butenyloxy)Coumarin

SCHEMBL18284641

CC=CCOc1ccc2ccc(=O)oc2c1

nearest known ligand 0.69

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 11/20 0.69
▸ CA1 P00915 11/20 0.69
▸ CA9 Q16790 11/20 0.69
▸ KDM4E B2RXH2 4/20 0.68
▸ MTNR1A P48039 4/20 0.68
▸ ALDH1A1 P00352 3/20 0.68
▸ MAOB P27338 3/20 0.68
▸ CA7 P43166 6/20 0.66
▸ CA6 P23280 5/20 0.66
▸ CA14 Q9ULX7 5/20 0.66
▸ CA4 P22748 5/20 0.66
▸ CA5B Q9Y2D0 3/20 0.66
▸ CA5A P35218 3/20 0.66
▸ CYP1A2 P05177 1/20 0.66
▸ CA2 P00918 3/20 0.62
▸ CA3 P07451 3/20 0.62
▸ ALOX15 P16050 2/20 0.62
▸ TDP1 Q9NUW8 2/20 0.62
▸ CYP3A4 P08684 2/20 0.62
▸ HPGD P15428 2/20 0.62

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
(E)-7-(2-Butenyloxy)Coumarin SCHEMBL12189889 1.00 CA12 (0.69) CA12CA1CA9KDM4EMTNR1A
SCHEMBL12189883 0.87 CA12 (0.68) CA12CA1CA9KDM4EMTNR1A
SCHEMBL12189878 0.84 CA12 (0.68) CA12CA1CA9KDM4EMTNR1A
SCHEMBL12189886 0.84 CA12 (0.68) CA12CA1CA9KDM4EMTNR1A
SCHEMBL4390495 0.83 CA12 (0.75) CA12CA1CA9KDM4EMTNR1A
7-Allyloxycoumarin SCHEMBL4765530 0.82 CA12 (1.00) CA12CA1CA9KDM4EMTNR1A
7-Prenyloxycoumarin SCHEMBL4898255 0.81 KDM4E (1.00) CA12CA1CA9KDM4EMTNR1A
SCHEMBL18292781 0.81 MTNR1A (0.67) CA12CA1CA9KDM4EMTNR1A
Ethoxycoumarin SCHEMBL119072 0.80 CA9 (1.00) CA12CA1CA9KDM4EMTNR1A
SCHEMBL12304245 0.79 CA12 (0.81) CA12CA1CA9KDM4EMTNR1A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016193220-A1 SKIN PIGMENTATION MODIFIERS TO DARKEN OR LIGHTEN THE SKIN AFFICHEM (FR) 2016-12-08 — — WO disclosed
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