SCHEMBL1092229

SCHEMBL1092229

CC(=O)c1ccc(OCc2ccc(C)cc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAOB P27338 11/20 1.00
MAOA P21397 2/20 0.73
PARP10 Q53GL7 2/20 0.73
ALDH1A1 P00352 2/20 0.69
MAPT P10636 1/20 0.69
MAPK1 P28482 1/20 0.69
HTT P42858 1/20 0.69
SMN1; SMN2 Q16637 1/20 0.69
L3MBTL1 Q9Y468 1/20 0.69
HRH3 Q9Y5N1 5/20 0.64

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
SCHEMBL6520330 0.86 RXRA (0.76) MAOBPARP10ALDH1A1MAPTMAPK1
SCHEMBL16550312 0.86 RXRA (0.76) MAOBPARP10ALDH1A1MAPTMAPK1
SCHEMBL933577 0.86 MAOB (0.76) MAOBMAOAALDH1A1MAPTHTT
SCHEMBL16395775 0.85 MAOB (1.00) MAOBMAOAALDH1A1HTTSMN1; SMN2
SCHEMBL2087139 0.85 MAOB (1.00) MAOBMAOAPARP10ALDH1A1HTT
SCHEMBL9778577 0.85 MAOB (1.00) MAOBMAOAALDH1A1HTTSMN1; SMN2
SCHEMBL13513249 0.84 MAOB (0.87) MAOBMAOAALDH1A1MAPTHTT
SCHEMBL42302 0.84 MAOB (1.00) MAOBMAOAPARP10ALDH1A1HTT
SCHEMBL18477942 0.84 L3MBTL1 (0.75) MAOBALDH1A1MAPTMAPK1SMN1; SMN2
SCHEMBL6959174 0.83 NPC1 (0.73) MAOBMAOAALDH1A1MAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109528716-B Application of chalcone compound containing carboxymethyl rhodanine structure 延边大学 2021-02-02 CN disclosed
CN-109528716-A The application of the chalcone compounds of the structure of rhodanine containing carboxymethyl 延边大学 2019-03-29 CN disclosed
US-8153634-B2 Carbinol derivatives having cyclic linker KOWA COMPANY, LTD. (JP) 2012-04-10 US disclosed
EP-2281817-A1 SUBSTITUTED CARBINOL COMPOUND HAVING CYCLIC LINKER Kowa Company, Ltd. (JP) 2011-02-09 EP disclosed
US-20100048610-A1 CARBINOL DERIVATIVES HAVING CYCLIC LINKER KOWA COMPANY, LTD. (JP) 2010-02-25 US disclosed
EP-0288297-B1 OPTICALLY ACTIVE BENZENE DERIVATIVES AND PROCESS FOR PREPARATION THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-03-17 EP disclosed
US-5063197-A Aromatic compound MITSUBISHI PAPER MILLS LIMITED (JP) 1991-11-05 US disclosed
US-4985590-A Optically active benzene derivatives and process for preparation thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-01-15 US disclosed
EP-0288297-A2 Optically active benzene derivatives and process for preparation thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-10-26 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-20100048610-A1 CARBINOL DERIVATIVES HAVING CYCLIC LINKER NR1H2, NR1H3, LDLR MAOB 3598/4885MAOA 4103/4885PARP10 2196/4885

“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.