SCHEMBL7554057

SCHEMBL7554057

COc1ccc2cc(C=CC(C)=O)ccc2c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.61
APP P05067 1/20 0.59
F3 P13726 2/20 0.56
FDPS P14324 1/20 0.55
IAPP P10997 1/20 0.54
PTGS1 P23219 1/20 0.54
THRB P10828 1/20 0.54
ATM Q13315 1/20 0.54
CYP3A4 P08684 3/20 0.53
GSK3B P49841 1/20 0.53
ABCG2 Q9UNQ0 2/20 0.53
PDE4A P27815 1/20 0.52
PDE4B Q07343 1/20 0.52
PDE4C Q08493 1/20 0.52
PDE4D Q08499 1/20 0.52
GAA P10253 1/20 0.51
HTT P42858 1/20 0.51
HDAC3 O15379 1/20 0.51
HDAC1 Q13547 1/20 0.51
HDAC2 Q92769 1/20 0.51

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
SCHEMBL7751575 1.00 MAOB (0.61) MAOBAPPF3FDPSIAPP
Acetone SCHEMBL22658412 0.92 MAOB (0.54) MAOBAPPF3FDPSIAPP
SCHEMBL14016920 0.89 IAPP (0.66) MAOBAPPFDPSIAPPPTGS1
SCHEMBL1480903 0.86 THRB (0.74) MAOBAPPF3THRBATM
SCHEMBL1480905 0.86 THRB (0.74) MAOBAPPF3THRBATM
SCHEMBL872010 0.85 F3 (0.75) MAOBF3THRBATMCYP3A4
SCHEMBL872009 0.85 F3 (0.75) MAOBF3THRBATMCYP3A4
SCHEMBL26124951 0.85 F3 (0.75) MAOBF3THRBATMCYP3A4
SCHEMBL1481293 0.85 TTR (0.61) MAOBAPPF3FDPSTHRB
SCHEMBL1481288 0.85 TTR (0.61) MAOBAPPF3FDPSTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1223156-A1 Use of 4-substituted 2-butanones to prepare nabumetone HOECHST CELANESE CORPORATION (US) 2002-07-17 EP claimed
EP-0937021-A1 PRODUCTION OF NABUMETONE OR PRECURSORS THEREOF ALBEMARLE CORPORATION (US) 1999-08-25 EP claimed
US-5907069-A METHYLATION OF 6-BROMO-2-NAPHTHOL WITH METHYL BROMIDE OR METHYL CHLORIDE AND RECOVERING NABUMETONE ALBEMARLE CORPORATION (US) 1999-05-25 US claimed
EP-0892775-A2 USE OF 4-SUBSTITUTED 2-BUTANONES TO PREPARE NABUMETONE HOECHST CELANESE CORPORATION (US) 1999-01-27 EP claimed
US-5847225-A Production of naphthyl-substituted ketones from naphthaldehydes ALBEMARLE CORPORATION (US) 1998-12-08 US claimed
US-5756851-A Production of nabumetone or precursors thereof ALBEMARLE CORPORATION (US) 1998-05-26 US claimed
WO-1998017616-A1 PRODUCTION OF NABUMETONE OR PRECURSORS THEREOF ALBEMARLE CORPORATION (US) 1998-04-30 WO claimed
US-5600009-A Use of 4-substituted 2-butanones to prepare nabumetone HOECHST CELANESE CORPORATION (US) 1997-02-04 US claimed
WO-1996040608-A2 USE OF 4-SUBSTITUTED 2-BUTANONES TO PREPARE NABUMETONE HOECHST CELANESE CORPORATION (US) 1996-12-19 WO claimed
US-5225603-A Preparation of 4-(6'-methoxy-2'-naphthyl)-3-buten-2-one HOECHST CELANESE CORPORATION (US) 1993-07-06 US claimed
JP-1287052-A None JP disclosed
US-12116383-B2 Oligosaccharide C-glycoside derivatives OKINAWA INSTITUTE OF SCIENCE AND TECHNOLOGY SCHOOL CORPORATION (JP) 2024-10-15 US disclosed
US-20220306671-A1 OLIGOSACCHARIDE C-GLYCOSIDE DERIVATIVES OKINAWA INSTITUTE OF SCIENCE AND TECHNOLOGY SCHOOL CORPORATION (JP) 2022-09-29 US disclosed
US-11401293-B2 Oligosaccharide c-glycoside derivatives OKINAWA INSTITUTE OF SCIENCE AND TECHNOLOGY SCHOOL CORPORATION (JP) 2022-08-02 US disclosed
EP-3768693-A1 OLIGOSACCHARIDE C-GLYCOSIDE DERIVATIVES Okinawa Institute of Science and Technology School Corporation (JP) 2021-01-27 EP disclosed
EP-0376516-A1 Method of preparation of nabumetone HOECHST CELANESE CORPORATION (US) 1990-07-04 EP disclosed
JP-H01287052-A NEW PRODUCTION METHOD FOR COMPOUND BEECHAM GROUP PLC 1989-11-17 JP disclosed
US-4426392-A Chemical compounds BEECHAM GROUP LIMITED (GB) 1984-01-17 US disclosed
US-4420639-A Aromatic compounds BEECHAM GROUP LIMITED (GB) 1983-12-13 US disclosed
US-4299844-A 2-Acyloxy-4-(6-substituted-2-naphthyl)butanes BEECHAM GROUP LIMITED (GB) 1981-11-10 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 (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-20220306671-A1 OLIGOSACCHARIDE C-GLYCOSIDE DERIVATIVES OSTC, FUT6, FUT5 MAOB 206/4885APP 2453/4885F3 260/4885
US-11401293-B2 Oligosaccharide c-glycoside derivatives OSTC, FUT6, FUT5 MAOB 206/4885APP 2453/4885F3 260/4885
US-12116383-B2 Oligosaccharide C-glycoside derivatives OSTC, FUT6, FUT5 MAOB 206/4885APP 2453/4885F3 260/4885

“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.