SCHEMBL7193226

SCHEMBL7193226

CC(C)(C)OC(=O)N1C(=O)CCC1c1ccc(-c2ccc(OC(F)(F)F)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 1/20 0.50
LIPE Q05469 1/20 0.45
ABHD6 Q9BV23 2/20 0.44
PDE5A O76074 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
SCD5 Q86SK9 1/20 0.41
HCRTR1 O43613 9/20 0.40
HCRTR2 O43614 9/20 0.40
KDM1A O60341 1/20 0.38
MAOB P27338 1/20 0.38
KCNH2 Q12809 1/20 0.37
SCN5A Q14524 1/20 0.37
SCN9A Q15858 1/20 0.37
EPHX2 P34913 1/20 0.37
DAGLA Q9Y4D2 1/20 0.37
PTPN2 P17706 1/20 0.37
PTPN1 P18031 1/20 0.37
PTPN6 P29350 1/20 0.37

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
SCHEMBL5620456 0.97 LIPE (0.47) GPR119LIPEABHD6PDE5AL3MBTL1
SCHEMBL6701246 0.85 HCRTR1 (0.46) GPR119PDE5AL3MBTL1SCD5HCRTR1
SCHEMBL4133494 0.85 HCRTR1 (0.46) GPR119PDE5AL3MBTL1SCD5HCRTR1
SCHEMBL7043219 0.82 DRD2 (0.40) GPR119L3MBTL1
SCHEMBL7043305 0.82 DRD2 (0.40) GPR119L3MBTL1
SCHEMBL22039428 0.82 HTR7 (0.42) L3MBTL1HCRTR2
SCHEMBL7236411 0.82 HTR7 (0.42) L3MBTL1HCRTR2
SCHEMBL7132988 0.82 AKR1C3 (0.37) GPR119PTPN2PTPN1PTPN6
SCHEMBL7233985 0.81 KDM1A (0.46) GPR119L3MBTL1KDM1A
SCHEMBL6832962 0.81 GPR119 (0.49) GPR119PTPN2PTPN1PTPN6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030220517-A1 Method for producing ketocarboxylic acid derivatives BAYER CROPSCIENCE AG (DE) 2003-11-27 US disclosed
WO-2002081489-A1 PALLADIUM-COMPLEXES BASED ON PYRROLINE-METAL COMPLEXES BAYER CROPSCIENCE AG (DE) 2002-10-17 WO 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-20030220517-A1 Method for producing ketocarboxylic acid derivatives CYP2F1, HK1, FBP1 GPR119 1397/4885LIPE 3358/4885ABHD6 804/4885

“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.