SCHEMBL7067933

SCHEMBL7067933

CCCCNC(=O)C(Cc1ccc(OCc2cnc3ccccc3c2)cc1)OCC

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
REN P00797 1/20 0.47
PLG P00747 6/20 0.47
PPARA Q07869 5/20 0.47
PRSS1 P07477 5/20 0.47
PRSS2 P07478 5/20 0.47
PRSS3 P35030 5/20 0.47
PPARG P37231 4/20 0.47
PPARD Q03181 2/20 0.47
PLAU P00749 1/20 0.44
SCN9A Q15858 1/20 0.41
HTT P42858 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
TRPV1 Q8NER1 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
SCHEMBL7067234 0.88 PPARA (0.51) PPARAPPARGPPARDSCN9A
SCHEMBL7069686 0.86 PPARA (0.49) PPARAPPARGPPARD
SCHEMBL7069420 0.85 PPARA (0.52) PPARAPPARGPPARDSCN9A
SCHEMBL7070013 0.85 PPARA (0.67) PPARAPPARGPPARD
SCHEMBL7066562 0.84 PPARA (0.53) PPARAPPARGPPARD
SCHEMBL7066775 0.84 PPARA (0.53) PPARAPPARGPPARDL3MBTL1
SCHEMBL7069298 0.83 PPARA (0.52) PPARAPPARGPPARD
SCHEMBL7070260 0.81 PPARA (0.53) PPARAPPARGPPARD
SCHEMBL7067696 0.80 PPARA (0.51) PPARAPPARGPPARDTRPV1
SCHEMBL7068924 0.80 PPARA (0.51) PPARAPPARGPPARDTRPV1

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 1 patent. 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

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 REN 2028/4885PLG 2483/4885PPARA 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.