Licocoumarone

Licocoumarone

SCHEMBL30220504

COc1c(CC=C(C)C)c(O)cc2oc(-c3ccc(O)cc3O)cc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 11/20 1.00
▸ DYRK1A Q13627 1/20 1.00
▸ AKT1 P31749 1/20 0.60
▸ CYP19A1 P11511 1/20 0.56
▸ PDE4D Q08499 3/20 0.51
▸ BCHE P06276 3/20 0.51
▸ ALOX5 P09917 1/20 0.49
▸ ALOX15 P16050 1/20 0.49
▸ ALOX12 P18054 1/20 0.49
▸ XDH P47989 1/20 0.49
▸ PDE4B Q07343 1/20 0.49
▸ TYR P14679 1/20 0.47
▸ TUBB4A P04350 1/20 0.47
▸ TUBB P07437 1/20 0.47
▸ TUBA3C P0DPH7 1/20 0.47
▸ TUBA1B P68363 1/20 0.47
▸ TUBA4A P68366 1/20 0.47
▸ TUBB4B P68371 1/20 0.47
▸ TUBB3 Q13509 1/20 0.47
▸ TUBB2A Q13885 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
Licocoumarone SCHEMBL758659 1.00 PTPN1 (1.00) PTPN1DYRK1AAKT1CYP19A1PDE4D
SCHEMBL29391195 0.93 PTPN1 (1.00) PTPN1DYRK1AAKT1CYP19A1PDE4D
SCHEMBL22704765 0.93 PTPN1 (1.00) PTPN1DYRK1AAKT1CYP19A1PDE4D
Glycycoumarin SCHEMBL759406 0.86 PTPN1 (0.75) PTPN1DYRK1AAKT1CYP19A1PDE4D
Glycycoumarin SCHEMBL29390258 0.86 PTPN1 (0.75) PTPN1DYRK1AAKT1CYP19A1PDE4D
SCHEMBL10702910 0.80 PTPN1 (0.66) PTPN1DYRK1AAKT1PDE4DALOX5
Glycyrin SCHEMBL5327472 0.79 PTPN1 (0.75) PTPN1DYRK1AAKT1PDE4DBCHE
Glycyrin SCHEMBL29388094 0.79 PTPN1 (0.75) PTPN1DYRK1AAKT1PDE4DBCHE
Mulberrofuran Z SCHEMBL31237321 0.75 PTPN1 (0.62) PTPN1DYRK1ACYP19A1BCHEHIF1A
SCHEMBL30637443 0.75 AKT1 (1.00) PTPN1DYRK1AAKT1CYP19A1PDE4D

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-111494231-B Application of three natural components in licorice root as tyrosinase inhibitor and whitening 上海青颜博识生物技术有限公司 2023-02-03 — — CN disclosed
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