SCHEMBL3359792

SCHEMBL3359792

O=Cc1ccc(OC2CCCCO2)c(OC2CCCCO2)c1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 4/20 0.49
ALDH1A1 P00352 6/20 0.40
TSHR P16473 1/20 0.40
KDM4E B2RXH2 1/20 0.40
PTPN1 P18031 3/20 0.38
FDPS P14324 1/20 0.36
ALDH1A3 P47895 1/20 0.35
PDE4D Q08499 1/20 0.35
AOX1 Q06278 1/20 0.34
TRIM24 O15164 1/20 0.34
HPGD P15428 1/20 0.34
ALDH5A1 P51649 1/20 0.34
ABAT P80404 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
TRIM33 Q9UPN9 1/20 0.34

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
SCHEMBL998425 0.92 PDE4B (0.59) PDE4BALDH1A1TSHRPTPN1FDPS
SCHEMBL667201 0.92 ALDH1A1 (0.54) PDE4BALDH1A1TSHRKDM4EPTPN1
SCHEMBL3362970 0.87 PDE4B (0.42) PDE4BALDH1A1KDM4EPTPN1ALDH1A3
SCHEMBL5863923 0.87 PDE4B (0.47) PDE4BALDH1A1TSHRKDM4EPTPN1
SCHEMBL10080332 0.87 PDE4B (0.42) PDE4BALDH1A1TSHRKDM4EPTPN1
SCHEMBL3594038 0.87 PDE4B (0.64) PDE4BALDH1A1TSHRKDM4EFDPS
SCHEMBL2770227 0.85 PDE4B (0.46) PDE4BPTPN1PDE4D
SCHEMBL16382600 0.84 PDE4B (0.40) PDE4BALDH1A1KDM4EPTPN1AOX1
SCHEMBL17754256 0.81 PDE4B (0.49) PDE4BALDH1A1KDM4EPTPN1PDE4D
SCHEMBL8528712 0.81 PDE4B (0.50) PDE4BALDH1A1KDM4EPTPN1PDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024231837-A1 NEW BORON-BASED COMPOUNDS FOR THE TREATMENT OF ALZHEIMER'S DISEASE UNIVERSITA' DEGLI STUDI DI TORINO (IT) 2024-11-14 WO claimed
WO-2024231837-A1 NEW BORON-BASED COMPOUNDS FOR THE TREATMENT OF ALZHEIMER'S DISEASE UNIVERSITA' DEGLI STUDI DI TORINO (IT) 2024-11-14 WO disclosed
EP-4277896-A1 ANTI-QUORUM SENSING, ANTI-BIOFILM, AND INFLAMMATION ATTENUATING COMPOUNDS, COMPOSITIONS, AND METHODS OF USING SAME B.G. Negev Technologies and Applications Ltd., at Ben-Gurion University (IL) 2023-11-22 EP disclosed
WO-2022153306-A1 ANTI-QUORUM SENSING, ANTI-BIOFILM, AND INFLAMMATION ATTENUATING COMPOUNDS, COMPOSITIONS, AND METHODS OF USING SAME B. G. NEGEV TECHNOLOGIES AND APPLICATIONS LTD., AT BEN-GURION UNIVERSITY (IL) 2022-07-21 WO disclosed
US-9139672-B2 Polymerizable compound, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2015-09-22 US disclosed
US-9139672-B2 Polymerizable compound, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2015-09-22 US disclosed
US-20140346399-A1 POLYMERIZABLE COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2014-11-27 US disclosed
US-20140346399-A1 POLYMERIZABLE COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2014-11-27 US disclosed
US-20130023567-A1 Novel Compounds SPEAR THERAPEUTICS LIMITED (GB) 2013-01-24 US disclosed
US-8236827-B2 Compounds SPEAR THERAPEUTICS LIMITED (GB) 2012-08-07 US disclosed
EP-0810201-A1 PREVENTIVE/REMEDY FOR LIVER DISEASE NISSHIN FLOUR MILLING CO., LTD. (JP) 1997-12-03 EP disclosed
EP-0466198-A1 A lipoxygenase inhibitor GREEN CROSS CORPORATION (JP) 1992-01-15 EP disclosed
EP-0466197-A1 A lipoxygenase inhibitor GREEN CROSS CORPORATION (JP) 1992-01-15 EP disclosed
EP-0464859-A1 A lipoxygenase inhibitor GREEN CROSS CORPORATION (JP) 1992-01-08 EP disclosed
EP-0464858-A1 A lipoxygenase inhibitor GREEN CROSS CORPORATION (JP) 1992-01-08 EP disclosed
US-4733002-A Lipoxygenase inhibitor GREEN CROSS CORPORATION (JP) 1988-03-22 US disclosed
EP-0163270-A2 A lipoxygenase inhibitor GREEN CROSS CORPORATION (JP) 1985-12-04 EP disclosed
US-4486602-A GLUCOSIDASE UNHIBITORS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1984-12-04 US disclosed
EP-0049981-B1 VALIENAMINE DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1984-07-25 EP disclosed
EP-0049981-A1 Valienamine derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1982-04-21 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 (1 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-20130023567-A1 Novel Compounds MKI67, RB1, CCND1 PDE4B 1903/4885ALDH1A1 1505/4885TSHR 799/4885

“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.