SCHEMBL4614641

SCHEMBL4614641

CCOC(=O)CCc1ccc(Oc2ccccc2CCN)cc1C

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.49
CYP4A11 Q02928 2/20 0.49
HRH1 P35367 1/20 0.47
P2RY10 O00398 4/20 0.42
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.42
HTR2A P28223 1/20 0.41
SLC6A4 P31645 1/20 0.41
TAAR1 Q96RJ0 1/20 0.40

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
SCHEMBL14289601 0.82 NPSR1 (0.47) CYP4F2CYP4A11ALDH1A1GAA
SCHEMBL4615204 0.81 HTR2A (0.45) HRH1P2RY10HTR2ASLC6A4
SCHEMBL4616676 0.81 NQO2 (0.42) CYP4F2CYP4A11P2RY10ALDH1A1GAA
SCHEMBL13921687 0.80 CYP4F2 (0.61) CYP4F2CYP4A11HRH1P2RY10ALDH1A1
SCHEMBL4516195 0.78 CYP4F2 (0.43) CYP4F2CYP4A11ALDH1A1GAA
SCHEMBL4502774 0.78 MEN1 (0.43) CYP4F2CYP4A11ALDH1A1GAA
SCHEMBL13678679 0.76 CYP4F2 (0.44) CYP4F2CYP4A11ALDH1A1GAA
SCHEMBL14519916 0.76 ALDH1A1 (0.58) CYP4F2CYP4A11ALDH1A1
SCHEMBL4517588 0.76 CYP4F2 (0.46) CYP4F2CYP4A11ALDH1A1GAA
SCHEMBL3631411 0.75 CYP4F2 (0.53) CYP4F2CYP4A11ALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1697304-B1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS LILLY CO ELI (US) 2008-02-20 EP disclosed
EP-1697304-B1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS LILLY CO ELI (US) 2008-02-20 EP disclosed
US-20070082907-A1 Peroxisome proliferator activated receptor modulators ELI LILLY AND COMPANY (IN) 2007-04-12 US disclosed
US-20070082907-A1 Peroxisome proliferator activated receptor modulators ELI LILLY AND COMPANY (IN) 2007-04-12 US disclosed
US-20070082907-A1 Peroxisome proliferator activated receptor modulators ELI LILLY AND COMPANY (IN) 2007-04-12 US disclosed
EP-1697304-A1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2006-09-06 EP disclosed
WO-2005054176-A1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2005-06-16 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-20070082907-A1 Peroxisome proliferator activated receptor modulators PPARG, PPARA, PPARD CYP4F2 408/4885CYP4A11 102/4885HRH1 2832/4885

“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.