SCHEMBL5845397

SCHEMBL5845397

CC(C)c1oc(-c2ccccc2Cl)nc1CCCC(=O)c1ccc(CC#N)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 4/20 0.44
PPARG P37231 3/20 0.44
PPARA Q07869 3/20 0.44
NR1H4 Q96RI1 1/20 0.39
ALDH1A1 P00352 4/20 0.38
LMNA P02545 2/20 0.38
KDM4E B2RXH2 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
NPC1 O15118 1/20 0.38
TP53 P04637 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MAPT P10636 2/20 0.38
POLB P06746 2/20 0.36
PTBP1 P26599 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36
ATM Q13315 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
PLA2G1B P04054 1/20 0.35
ATG4B Q9Y4P1 1/20 0.35
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL5845540 0.94 PPARD (0.45) PPARDPPARGPPARANR1H4ALDH1A1
SCHEMBL5846365 0.90 PPARD (0.46) PPARDPPARGPPARANR1H4ALDH1A1
SCHEMBL30003787 0.89 PPARD (0.45) PPARDPPARGPPARANR1H4ALDH1A1
SCHEMBL5845148 0.89 PPARD (0.45) PPARDPPARGPPARANR1H4ALDH1A1
SCHEMBL30003783 0.89 PPARD (0.45) PPARDPPARGPPARANR1H4ALDH1A1
SCHEMBL24658486 0.89 PPARD (0.45) PPARDPPARGPPARANR1H4ALDH1A1
SCHEMBL1765909 0.88 PPARD (0.46) PPARDPPARGPPARANR1H4ALDH1A1
SCHEMBL5846793 0.84 PPARD (0.47) PPARDPPARGPPARANR1H4ALDH1A1
SCHEMBL7102199 0.83 PPARD (0.49) PPARDPPARGPPARANR1H4ALDH1A1
SCHEMBL376890 0.82 PPARG (0.49) PPARDPPARGPPARAALDH1A1LMNA

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-7078422-B2 Activator for peroxisome proliferator-activated receptor NIPPON CHEMIPHAR CO., LTD. (JP) 2006-07-18 US disclosed
US-20040152744-A1 Activator for peroxisome proliferator- activated receptor NIPPON CHEMIPHAR CO., LTD. (JP) 2004-08-05 US disclosed
EP-1371650-A1 ACTIVATOR FOR PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR NIPPON CHEMIPHAR CO., LTD. (JP) 2003-12-17 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-20040152744-A1 Activator for peroxisome proliferator- activated receptor PPARA, PPARG, PPARD PPARD 3/4885PPARG 2/4885PPARA 1/4885

“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.