Phellamurin

Phellamurin

SCHEMBL30291874

CC(C)=CCc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c1O[C@H](c1ccc(O)cc1)[C@@H](O)C2=O

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 2/20 0.47
▸ SLCO2B1 O94956 2/20 0.47
▸ PDE5A O76074 2/20 0.45
▸ KDM1A O60341 2/20 0.45
▸ POLB P06746 1/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ USP2 O75604 1/20 0.45
▸ ESR1 P03372 4/20 0.45
▸ AKR1B10 O60218 2/20 0.45
▸ AKR1B1 P15121 2/20 0.45
▸ PDPK1 O15530 1/20 0.45
▸ PRKCA P17252 1/20 0.45
▸ BACE1 P56817 1/20 0.45
▸ PRKCQ Q04759 1/20 0.45
▸ SLC28A3 Q9HAS3 4/20 0.44
▸ ESR2 Q92731 3/20 0.44
▸ CACNA1G O43497 1/20 0.44
▸ CACNA1H O95180 1/20 0.44
▸ MAOA P21397 1/20 0.44
▸ ABCG2 Q9UNQ0 1/20 0.44

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
Phellamurin SCHEMBL27013577 1.00 PTPN1 (0.47) PTPN1SLCO2B1PDE5AKDM1APOLB
SCHEMBL4742873 0.94 PTPN1 (0.46) PTPN1SLCO2B1PDE5AKDM1APOLB
SCHEMBL19004052 0.85 ESR1 (0.65) PTPN1SLCO2B1PDE5AKDM1APOLB
Neophellamuretin SCHEMBL30766255 0.80 ABCG2 (0.66) PTPN1PDE5APOLBESR1AKR1B10
Neophellamuretin SCHEMBL27013455 0.80 ABCG2 (0.66) PTPN1PDE5APOLBESR1AKR1B10
SCHEMBL19463533 0.80 PTPN1 (0.62) PTPN1SLCO2B1PDE5AKDM1APOLB
SCHEMBL19463534 0.80 PTPN1 (0.62) PTPN1SLCO2B1PDE5AKDM1APOLB
SCHEMBL27161054 0.78 SLCO2B1 (0.69) PTPN1SLCO2B1KDM1APOLBKDM4E
SCHEMBL29369929 0.78 SLCO2B1 (0.69) PTPN1SLCO2B1KDM1APOLBKDM4E
SCHEMBL27006405 0.78 ESR1 (0.68) PDE5AESR1AKR1B10AKR1B1PDPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240245741-A1 EXTRACTION METHOD USING AN AQUEOUS ALKANEDIOL MINASOLVE SAS (FR) 2024-07-25 — — US disclosed
EP-4401852-A1 EXTRACTION METHOD USING AN AQUEOUS ALKANEDIOL Minasolve SAS (FR) 2024-07-24 — — EP disclosed
WO-2023036973-A1 EXTRACTION METHOD USING AN AQUEOUS ALKANEDIOL MINASOLVE SAS (FR) 2023-03-16 — — WO disclosed
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