SCHEMBL871319

SCHEMBL871319

[O-][n+]1ccccc1-c1cccc[n+]1[O-]

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.52
HTT P42858 1/20 0.52
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
KDM4E B2RXH2 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ALDH1A1 P00352 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HDAC8 Q9BY41 2/20 0.36
RAB9A P51151 3/20 0.35
NPC1 O15118 2/20 0.34
SLC2A1 P11166 1/20 0.34
ABCC9 O60706 2/20 0.34
ABCC8 Q09428 2/20 0.34
KCNJ11 Q14654 2/20 0.34
KCNJ8 Q15842 2/20 0.34
GABRG2 P18507 1/20 0.32
GABRB3 P28472 1/20 0.32
GABRA5 P31644 1/20 0.32
GABRA3 P34903 1/20 0.32

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
SCHEMBL29727517 1.00 LMNA (0.52) LMNAHTTKMT2AMEN1KDM4E
SCHEMBL316983 0.84 HTT (0.44) LMNAHTTKMT2AMEN1KDM4E
SCHEMBL31088294 0.84 HTT (0.44) LMNAHTTKMT2AMEN1KDM4E
SCHEMBL4635144 0.82 LMNA (0.43) LMNAHTTKMT2AMEN1KDM4E
SCHEMBL308766 0.80 HTT (0.38) LMNAHTTKMT2AMEN1KDM4E
SCHEMBL9716203 0.80 LMNA (0.41) LMNAHTTKMT2AMEN1KDM4E
SCHEMBL31509682 0.78 LMNA (0.40) LMNAHTTKMT2AMEN1KDM4E
SCHEMBL8755109 0.78 LMNA (0.40) LMNAHTTKMT2AMEN1KDM4E
SCHEMBL8137353 0.77
SCHEMBL31547630 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113559939-B Alpha alkylation reaction catalyst of nitrile and preparation method thereof 郑州大学 2023-06-23 CN claimed
CN-113713858-B Alpha alkylation reaction catalyst of nitrile and preparation method thereof 郑州大学 2023-06-23 CN claimed
US-20200123673-A1 ELECTROLYTIC TIN ALLOY PLATING SOLUTION C. UYEMURA & CO., LTD. (JP) 2020-04-23 US claimed
US-7544819-B2 Process for the asymmetric epoxidation of olefins LANXESS DEUTSCHLAND GMBH (DE) 2009-06-09 US claimed
US-20050203303-A1 Process for the asymmetric epoxidation of olefins LANXESS DEUTSCHLAND GMBH (DE) 2005-09-15 US claimed
EP-0377357-B1 Process for the condensation of at least one epoxide on at least one cyclic anhyhride in the presence of a titanium-based catalyst INST FRANCAIS DU PETROLE (FR) 1994-03-23 EP claimed
EP-0397474-A2 Photosensitive composition KABUSHIKI KAISHA TOSHIBA (JP) 1990-11-14 EP claimed
CN-113683557-B Application of cyclopentadienyl iridium/rhodium dimer 南京师范大学 2023-07-14 CN disclosed
CN-113559939-B Alpha alkylation reaction catalyst of nitrile and preparation method thereof 郑州大学 2023-06-23 CN disclosed
CN-113713858-B Alpha alkylation reaction catalyst of nitrile and preparation method thereof 郑州大学 2023-06-23 CN disclosed
CN-113683557-A Application of cyclopentadienyl iridium/rhodium dimer 南京师范大学 2021-11-23 CN disclosed
CN-108530343-B Rhein specific group modified organic compound, aryl metal complex thereof, preparation method and application thereof 南京师范大学 2021-07-27 CN disclosed
EP-2552443-B1 IMPROVED TREATMENT OF RENAL CELL CARCINOMA ONCORENA AB (SE) 2021-07-14 EP disclosed
EP-0108437-B1 PROCESS FOR THE PREPARATION OF ETHYLIDENE DIACETATE AND/OR ACETIC ACID ANHYDRIDE SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1986-05-14 EP disclosed
US-4529824-A Vanadium, niobium or tanatlum peroxidic complex INSTITUT FRANCAIS DU PETROLE (FR) 1985-07-16 US disclosed
EP-0108437-A1 Process for the preparation of ethylidene diacetate and/or acetic acid anhydride SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1984-05-16 EP disclosed
EP-0002963-B1 AQUEOUS STABILIZED FLUORESCENT LABELS, PROTEINS LABELLED THEREWITH AND METHODS OF USE EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1983-12-21 EP disclosed
EP-0041587-A1 Catalyst compositions, production thereof, and use in production of oxygenated organic compounds THE STANDARD OIL COMPANY (US) 1981-12-16 EP disclosed
EP-0002963-A1 Aqueous stabilized fluorescent labels, proteins labelled therewith and methods of use EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1979-07-11 EP disclosed
US-3980654-A Copper (II) complexes EASTMAN KODAK COMPANY (US) 1976-09-14 US 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-20050203303-A1 Process for the asymmetric epoxidation of olefins DUOX1, DUOX2, PPOX LMNA 4838/4885HTT 4263/4885KMT2A 3147/4885

“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.