Coumarin

Coumarin

SCHEMBL28038376

CCCCCC(=O)CCCCC.O=c1ccc2ccccc2o1

nearest known ligand 0.59

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.59
CA1 P00915 3/20 0.59
CA2 P00918 3/20 0.59
CA6 P23280 3/20 0.59
CA7 P43166 3/20 0.59
CA9 Q16790 3/20 0.59
CA14 Q9ULX7 3/20 0.59
CA5B Q9Y2D0 3/20 0.59
LMNA P02545 3/20 0.59
CA3 P07451 2/20 0.59
CA4 P22748 2/20 0.59
CA5A P35218 2/20 0.59
MCL1 Q07820 1/20 0.59
SOST Q9BQB4 1/20 0.59
TDP1 Q9NUW8 1/20 0.59
ALDH1A1 P00352 2/20 0.49
SMN1; SMN2 Q16637 3/20 0.46
KDM4E B2RXH2 1/20 0.46
MAOB P27338 2/20 0.45
MAOA P21397 1/20 0.45

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
Stearic Acid SCHEMBL4535448 0.89 TDP1 (0.56) CA12CA1CA2CA6CA7
Palmitic Acid SCHEMBL28715453 0.89 TDP1 (0.56) CA12CA1CA2CA6CA7
Myristic Acid SCHEMBL28706218 0.89 TDP1 (0.56) CA12CA1CA2CA6CA7
Hexadecanoic Acid Methyl Ester SCHEMBL31299915 0.85 LMNA (0.51) CA12CA1CA2CA6CA7
Coumarin SCHEMBL2197947 0.85 CA12 (0.62) CA12CA1CA2CA6CA7
Coumarin SCHEMBL31506344 0.84 CA12 (0.61) CA12CA1CA2CA6CA7
Myristyl Alcohol SCHEMBL28340457 0.84 CA12 (0.61) CA12CA1CA2CA6CA7
Coumarin SCHEMBL28342910 0.84 CA12 (0.61) CA12CA1CA2CA6CA7
Dodecanol SCHEMBL28342893 0.84 CA12 (0.61) CA12CA1CA2CA6CA7
Coumarin SCHEMBL28597444 0.83 CA9 (0.69) CA12CA1CA2CA6CA7

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 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107098877-A A kind of synthetic method of medicine intermediate aryl ketones coumarin derivative 钱小英 2017-08-29 CN claimed
CN-107098878-A The synthetic method of medicine intermediate aryl ketones coumarin derivative 钱小英 2017-08-29 CN claimed
CN-107011305-A A kind of synthetic method of medicine intermediate aryl ketones coumarin derivative 钱小英 2017-08-04 CN claimed
CN-106977480-A The synthetic method of medicine intermediate aryl ketones coumarin derivative 钱小英 2017-07-25 CN claimed
CN-106946824-A A kind of synthetic method of medicine intermediate aryl ketones coumarin derivative 钱小英 2017-07-14 CN claimed
CN-106946825-A The synthetic method of medicine intermediate aryl ketones coumarin derivative 钱小英 2017-07-14 CN claimed
CN-105175373-B Synthetic method of aryl ketone coumarin derivative 张鑫 2017-05-03 CN claimed
CN-105175373-A Synthetic method of aryl ketone coumarin derivative PAN XINGXING 2015-12-23 CN claimed
CN-107098877-A A kind of synthetic method of medicine intermediate aryl ketones coumarin derivative 钱小英 2017-08-29 CN disclosed
CN-107098877-A A kind of synthetic method of medicine intermediate aryl ketones coumarin derivative 钱小英 2017-08-29 CN disclosed
CN-107098877-A A kind of synthetic method of medicine intermediate aryl ketones coumarin derivative 钱小英 2017-08-29 CN disclosed
CN-107098878-A The synthetic method of medicine intermediate aryl ketones coumarin derivative 钱小英 2017-08-29 CN disclosed
CN-107098878-A The synthetic method of medicine intermediate aryl ketones coumarin derivative 钱小英 2017-08-29 CN disclosed
CN-107098878-A The synthetic method of medicine intermediate aryl ketones coumarin derivative 钱小英 2017-08-29 CN disclosed
CN-105175373-B Synthetic method of aryl ketone coumarin derivative 张鑫 2017-05-03 CN disclosed
CN-105175373-B Synthetic method of aryl ketone coumarin derivative 张鑫 2017-05-03 CN disclosed
CN-105175373-B Synthetic method of aryl ketone coumarin derivative 张鑫 2017-05-03 CN disclosed
CN-105175373-A Synthetic method of aryl ketone coumarin derivative PAN XINGXING 2015-12-23 CN disclosed
CN-105175373-A Synthetic method of aryl ketone coumarin derivative PAN XINGXING 2015-12-23 CN disclosed
CN-105175373-A Synthetic method of aryl ketone coumarin derivative PAN XINGXING 2015-12-23 CN disclosed