Coumarin

Coumarin

SCHEMBL28832874

O=c1ccc2ccccc2o1.c1ccc2cc3cc4cc5ccccc5cc4cc3cc2c1

nearest known ligand 0.83

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 9/20 0.83
▸ CA9 Q16790 9/20 0.83
▸ CA1 P00915 6/20 0.83
▸ CA4 P22748 5/20 0.83
▸ CA7 P43166 5/20 0.83
▸ CA14 Q9ULX7 5/20 0.83
▸ CA3 P07451 4/20 0.83
▸ CA5A P35218 4/20 0.83
▸ CA6 P23280 4/20 0.83
▸ MCL1 Q07820 3/20 0.83
▸ CA2 P00918 3/20 0.83
▸ CA5B Q9Y2D0 3/20 0.83
▸ TDP1 Q9NUW8 2/20 0.83
▸ LMNA P02545 1/20 0.83
▸ SOST Q9BQB4 1/20 0.83
▸ PGR P06401 1/20 0.55
▸ KMT2A Q03164 4/20 0.52
▸ ALDH1A1 P00352 3/20 0.52
▸ HPGD P15428 3/20 0.52
▸ KDM4E B2RXH2 3/20 0.52

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
Anthracene SCHEMBL27920463 0.98 CA12 (0.87) CA12CA9CA1CA4CA7
Coumarin SCHEMBL621751 0.91 CA12 (1.00) CA12CA9CA1CA4CA7
Coumarin SCHEMBL28886137 0.91 CA12 (1.00) CA12CA9CA1CA4CA7
Coumarin SCHEMBL1038138 0.91 CA12 (1.00) CA12CA9CA1CA4CA7
Coumarin SCHEMBL3441294 0.91 CA12 (1.00) CA12CA9CA1CA4CA7
Coumarin SCHEMBL6252 0.91 CA12 (1.00) CA12CA9CA1CA4CA7
Coumarin SCHEMBL29385611 0.91 CA12 (1.00) CA12CA9CA1CA4CA7
Coumarin SCHEMBL6002552 0.89 CA12 (0.95) CA12CA9CA1CA4CA7
Coumarin SCHEMBL4958503 0.89 CA12 (0.95) CA12CA9CA1CA4CA7
Coumarin SCHEMBL22721260 0.89 CA12 (0.95) CA12CA9CA1CA4CA7

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
CN-105830228-A Precursor of inorganic/organic hybrid perovskite compound 韩国化学研究院 2016-08-03 — — CN disclosed
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