SCHEMBL5433904

SCHEMBL5433904

CCC(=NOCCOc1cccc(CC(=O)O)c1)c1ccc(-c2ccc(CC)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G4B P0C869 2/20 0.45
PPARG P37231 1/20 0.45
LTB4R Q15722 1/20 0.42
NR1H3 Q13133 1/20 0.41
PPARD Q03181 1/20 0.41
PTPN11 Q06124 1/20 0.40
ROCK2 O75116 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
ROCK1 Q13464 1/20 0.40
CYP4F2 P78329 1/20 0.40
CYP4A11 Q02928 1/20 0.40
RXRA P19793 1/20 0.40
RXRB P28702 1/20 0.40
KDM4E B2RXH2 3/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL5433896 1.00 PLA2G4B (0.45) PLA2G4BPPARGLTB4RNR1H3PPARD
SCHEMBL5419304 0.97 PLA2G4B (0.47) PLA2G4BPPARGLTB4RNR1H3PPARD
SCHEMBL5419296 0.97 PLA2G4B (0.47) PLA2G4BPPARGLTB4RNR1H3PPARD
SCHEMBL5414627 0.94 PPARG (0.51) PLA2G4BPPARGLTB4RNR1H3PPARD
SCHEMBL5427796 0.94 PPARG (0.51) PLA2G4BPPARGLTB4RNR1H3PPARD
SCHEMBL5414621 0.94 PPARG (0.51) PLA2G4BPPARGLTB4RNR1H3PPARD
SCHEMBL5416785 0.92 PLA2G4B (0.45) PLA2G4BPPARGLTB4RNR1H3PPARD
SCHEMBL5416794 0.92 PLA2G4B (0.45) PLA2G4BPPARGLTB4RNR1H3PPARD
SCHEMBL5426964 0.91 PPARG (0.44) PLA2G4BPPARGLTB4RNR1H3PPARD
SCHEMBL5423777 0.91 NR1H3 (0.49) PLA2G4BPPARGLTB4RNR1H3PPARD

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-20070167490-A1 Imino ether derivative compounds and drugs containing the compounds as the active ingredient ONO PHARMACEUTICAL CO LTD 2007-07-19 US disclosed
EP-1602642-A1 IMINO ETHER DERIVATIVE COMPOUNDS AND DRUGS CONTAINING THE COMPOUNDS AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2005-12-07 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-20070167490-A1 Imino ether derivative compounds and drugs containing the compounds as the active ingredient INSR, NR1H2, NR1H3 PLA2G4B 2091/4885PPARG 18/4885LTB4R 758/4885

“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.