SCHEMBL3817639

SCHEMBL3817639

O=C(O)Cc1ccc(OCc2ccccc2)c(OCc2ccccc2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.55
SLC22A12 Q96S37 1/20 0.55
FFAR1 O14842 1/20 0.55
FOLH1 Q04609 1/20 0.54
RXRB P28702 3/20 0.53
RXRA P19793 2/20 0.53
RXRG P48443 2/20 0.53
SLC2A1 P11166 1/20 0.52
AKR1B1 P15121 1/20 0.52
PTGER1 P34995 1/20 0.51
PTGER4 P35408 1/20 0.51
PTGER3 P43115 1/20 0.51
PTGER2 P43116 1/20 0.51
POLB P06746 1/20 0.51
MAPT P10636 1/20 0.51
THRB P10828 1/20 0.51
MTNR1A P48039 1/20 0.50
MTNR1B P49286 1/20 0.50
APP P05067 1/20 0.50
KDM4E B2RXH2 1/20 0.50

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
SCHEMBL6035750 0.93 MAPT (0.61) FFAR4SLC22A12POLBMAPTTHRB
SCHEMBL9077917 0.91 SLC2A1 (0.52) FFAR4SLC22A12FFAR1SLC2A1MTNR1A
SCHEMBL9076148 0.91 SLC2A1 (0.52) FFAR4SLC22A12FFAR1SLC2A1MTNR1A
SCHEMBL1114985 0.91 NPC1 (0.63) RXRAPTGER4PTGER2MTNR1AMTNR1B
SCHEMBL31011346 0.91 NPC1 (0.63) RXRAPTGER4PTGER2MTNR1AMTNR1B
SCHEMBL2391945 0.91 SMPD1 (0.61) FFAR4FFAR1RXRAMTNR1AMTNR1B
SCHEMBL6214774 0.87 FOLH1 (0.51) FFAR4FFAR1FOLH1RXRASLC2A1
SCHEMBL8072945 0.87 PTGER1 (0.52) FFAR4FFAR1FOLH1RXRBRXRA
SCHEMBL8975189 0.87 MTNR1A (0.54) FFAR4FOLH1RXRASLC2A1POLB
SCHEMBL10477771 0.87 FOLH1 (0.55) FFAR4FFAR1FOLH1RXRASLC2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115212314-A Albumin-bound antitumor drug and nano-composite thereof, and preparation method and application thereof 沈阳药科大学 2022-10-21 CN claimed
US-20240217945-A1 ENANTIOMERIC ENTACTOGEN COMPOSITIONS AND THEIR USE ARCADIA MEDICINE, INC. 2024-07-04 US disclosed
CN-115212314-B Albumin combined anti-tumor medicine and nano-composite thereof, preparation method and application 沈阳药科大学 2024-04-30 CN disclosed
CN-114195640-B Synthesis process of hydroxytyrosol and intermediate thereof 攀枝花学院 2024-03-12 CN disclosed
US-20230382885-A1 ENANTIOMERIC ENTACTOGEN COMPOSITIONS AND THEIR USE ARCADIA MEDICINE, INC. 2023-11-30 US disclosed
CN-116444569-A Triphenylhydroxytyrosol and synthesis method thereof and application of triphenylhydroxytyrosol in preparation of medicines for improving aortic endothelial cell functions 西安交通大学 2023-07-18 CN disclosed
CN-115850334-A Triphenylphosphonium-hydroxytyrosol, synthesis method thereof and application thereof in preparing drugs for inhibiting cancer cell proliferation 西安交通大学 2023-03-28 CN disclosed
CN-115212314-A Albumin-bound antitumor drug and nano-composite thereof, and preparation method and application thereof 沈阳药科大学 2022-10-21 CN disclosed
CN-114195640-A Synthetic process of hydroxytyrosol and intermediate thereof 攀枝花学院 2022-03-18 CN disclosed
CN-108276367-B Bromo-furanone ester compound and preparation method and application thereof 暨南大学 2020-05-08 CN disclosed
EP-2086922-A2 ISOLATED HYDROXY AND N-OXIDE METABOLITES AND DERIVATIVES OF O-DESMETHYLVENLAFAXINE AND METHODS OF TREATMENT Wyeth (US) 2009-08-12 EP disclosed
US-20080261895-A1 Isolated hydroxy and n-oxide metabolites and derivatives of O-desmethylvenlafaxine and methods of treatment WYETH 2008-10-23 US disclosed
WO-2008051558-A2 ISOLATED HYDROXY AND N-OXIDE METABOLITES AND DERIVATIVES OF O-DESMETHYLVENLAFAXINE AND METHODS OF TREATMENT WYETH (US) 2008-05-02 WO disclosed
WO-2008047382-A2 A PROCESS FOR THE PREPARATION OF 4-[2-[[3-(4-HYDROXYPHENYL)-1-METHYLPROPYL]AMINO]ETHYL]-1,2-BENZENEDIOL SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2008-04-24 WO disclosed
US-5665765-A TREATMENT OF PARKINSON'S DISEASE, MEMORY DISORDERS, DISORDERS ASSOCIATED WITH DRUG ABUSE, DEPRESSION, AND PSYCHOTIC STATES ADIR ET COMPAGNIE (FR) 1997-09-09 US disclosed
US-5047430-A Glutamate Receptor Inhibitors TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1991-09-10 US disclosed
US-4990511-A Amide compounds, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1991-02-05 US disclosed
EP-0353753-A1 Amide compounds, their production and use Takeda Chemical Industries, Ltd. (JP) 1990-02-07 EP disclosed
EP-0339927-A2 Amide compounds their production and use Takeda Chemical Industries, Ltd. (JP) 1989-11-02 EP disclosed
EP-0215736-A1 Xanthine derivatives, processes for their production and their use as pharmaceuticals SANDOZ AG (CH) 1987-03-25 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240217945-A1 ENANTIOMERIC ENTACTOGEN COMPOSITIONS AND THEIR USE HTR1A, PNMT, HTR2C FFAR4 2397/4885SLC22A12 948/4885FFAR1 2787/4885
US-20080261895-A1 Isolated hydroxy and n-oxide metabolites and derivatives of O-desmethylvenlafaxine and methods of treatment UGT1A4, SLC6A4, UGT1A3 FFAR4 181/4885SLC22A12 652/4885FFAR1 514/4885
US-20230382885-A1 ENANTIOMERIC ENTACTOGEN COMPOSITIONS AND THEIR USE HTR1A, PNMT, HTR2C FFAR4 2397/4885SLC22A12 948/4885FFAR1 2787/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.