SCHEMBL7069916

SCHEMBL7069916

CCOC(=O)C(Cc1ccc(OCc2cc(OC)c3ccccc3n2)cc1)OCC

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 2/20 0.50
LPAR1 Q92633 1/20 0.50
PPARA Q07869 11/20 0.48
PPARG P37231 8/20 0.48
PPARD Q03181 5/20 0.48
PDE4A P27815 2/20 0.46
PDE4B Q07343 2/20 0.46
PDE3B Q13370 2/20 0.46
PDE3A Q14432 2/20 0.46
PDE10A Q9Y233 2/20 0.46
P2RY12 Q9H244 1/20 0.44
CYSLTR2 Q9NS75 3/20 0.44
CYSLTR1 Q9Y271 3/20 0.44
ADAM17 P78536 1/20 0.42

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
SCHEMBL7070000 0.92 PPARA (0.58) LPAR3LPAR1PPARAPPARGPPARD
SCHEMBL7069921 0.86 ALOX15 (0.41) LPAR3LPAR1PDE4APDE4BPDE3B
SCHEMBL7072259 0.80 ADAM17 (0.56) PPARAPPARGPPARDPDE10AADAM17
SCHEMBL16429583 0.80 MAOB (0.55) LPAR3PPARAPPARGPPARD
SCHEMBL22061729 0.80 MAOB (0.55) LPAR3PPARAPPARGPPARD
SCHEMBL4758109 0.78 PPARA (0.75) PPARAPPARGPPARD
SCHEMBL5338861 0.78 PPARA (0.75) PPARAPPARGPPARD
SCHEMBL15811673 0.78 PPARA (0.75) PPARAPPARGPPARD
SCHEMBL7070005 0.78 ALOX15 (0.43) LPAR3LPAR1PPARAPPARGPPARD
SCHEMBL6555798 0.77 KDM4E (0.59) PPARAPPARGPPARDPDE10A

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-20030212100-A1 Quinoline derivatives and medicinal use thereof MITSUI CHEMICALS, INC. (JP) 2003-11-13 US disclosed
EP-1266888-A1 QUINOLINE DERIVATIVES AND MEDICINAL USE THEREOF Mitsui Chemicals, Inc. (JP) 2002-12-18 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-20030212100-A1 Quinoline derivatives and medicinal use thereof PPARG, PPARD, PPARA LPAR3 3405/4885LPAR1 2972/4885PPARA 3/4885

“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.