Coumarin

Coumarin

SCHEMBL28486266

CCCCCC1C(=O)Oc2ccccc21.O=c1ccc2ccccc2o1

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.47
CA1 P00915 2/20 0.47
CA2 P00918 2/20 0.47
CA3 P07451 2/20 0.47
CA4 P22748 2/20 0.47
CA6 P23280 2/20 0.47
CA7 P43166 2/20 0.47
CA9 Q16790 2/20 0.47
CA14 Q9ULX7 2/20 0.47
CA5B Q9Y2D0 2/20 0.47
LMNA P02545 1/20 0.47
CA5A P35218 1/20 0.47
MCL1 Q07820 1/20 0.47
SOST Q9BQB4 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
GRM8 O00222 3/20 0.38
GRM1 Q13255 3/20 0.38
GRM7 Q14831 3/20 0.38
GRM4 Q14833 3/20 0.38
GRM5 P41594 2/20 0.37

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
SCHEMBL480910 0.85 KMT2A (0.47) GRM8GRM1GRM7GRM4GRM5
SCHEMBL4592036 0.81 KMT2A (0.46) LMNAGRM8GRM1GRM7GRM4
Propionamide SCHEMBL28290130 0.77 GRM8 (0.48) GRM8GRM1GRM7GRM4GRM5
SCHEMBL10481361 0.75 KMT2A (0.44) GRM8GRM1GRM7GRM4GRM5
SCHEMBL7174908 0.74 GRM8 (0.39) GRM8GRM1GRM7GRM4GRM5
SCHEMBL6125509 0.73 KMT2A (0.51) GRM8GRM1GRM7GRM4GRM5
Coumarin SCHEMBL1707602 0.73 CA12 (0.80) CA12CA1CA2CA3CA4
Coumarin SCHEMBL2197947 0.73 CA12 (0.62) CA12CA1CA2CA3CA4
Coumarin SCHEMBL28966037 0.73 CA12 (0.62) CA12CA1CA2CA3CA4
Coumarin SCHEMBL28477322 0.73 CA12 (0.62) CA12CA1CA2CA3CA4

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-111920797-A Application of 3-aryl benzofuranone compound 山东省医学科学院药物研究所(山东省抗衰老研究中心、山东省新技术制药研究所) 2020-11-13 CN disclosed