SCHEMBL5361655

SCHEMBL5361655

C/C(C=O)=C\C1(C(=O)OCc2ccc(Cl)cc2)CC1(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
MAPT P10636 1/20 0.39
MAOA P21397 3/20 0.37
MAOB P27338 3/20 0.37
FFAR4 Q5NUL3 1/20 0.36
L3MBTL1 Q9Y468 3/20 0.34
ALDH1A1 P00352 2/20 0.34
GAA P10253 2/20 0.34
MMP2 P08253 2/20 0.34
MMP1 P03956 1/20 0.34
MMP9 P14780 1/20 0.34
MMP12 P39900 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
HTR2A P28223 1/20 0.34
MAPK1 P28482 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
SCHEMBL5361661 1.00 MEN1 (0.39) MEN1KMT2ANPSR1MAPTMAOA
SCHEMBL5362016 0.87 ALDH1A1 (0.46) KMT2AL3MBTL1ALDH1A1MAPK1
SCHEMBL5362010 0.87 ALDH1A1 (0.46) KMT2AL3MBTL1ALDH1A1MAPK1
SCHEMBL5369497 0.85 NPSR1 (0.39) MEN1KMT2ANPSR1MAPTMAOA
SCHEMBL5373472 0.85 MEN1 (0.39) MEN1KMT2ANPSR1MAPTMAOA
SCHEMBL5373476 0.85 MEN1 (0.39) MEN1KMT2ANPSR1MAPTMAOA
SCHEMBL5369499 0.85 NPSR1 (0.39) MEN1KMT2ANPSR1MAPTMAOA
SCHEMBL5370679 0.76 TDP1 (0.51) FFAR4L3MBTL1MMP2MMP1MMP9
SCHEMBL5370676 0.76 TDP1 (0.51) FFAR4L3MBTL1MMP2MMP1MMP9
SCHEMBL5367074 0.75 POLB (0.38) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7276622-B2 Method for producing oxygen-containing compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-10-02 US disclosed
US-20060173221-A1 Method for producing oxygen-containing compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-08-03 US disclosed
EP-1609777-A1 METHOD FOR PRODUCING OXYGEN-CONTAINING COMPOUND Sumitomo Chemical Company, Limited (JP) 2005-12-28 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-20060173221-A1 Method for producing oxygen-containing compound GPX4, DUOX2, SCO2 MEN1 2707/4885KMT2A 2326/4885NPSR1 4645/4885

“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.