SCHEMBL7070113

SCHEMBL7070113

CCOC(Cc1ccccc1OCc1cnc2ccccc2c1OC)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARG P37231 15/20 0.40
PPARA Q07869 15/20 0.40
PPARD Q03181 7/20 0.40
ALDH1A1 P00352 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
MAPT P10636 1/20 0.36
ABCB1 P08183 1/20 0.35
ABCG2 Q9UNQ0 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
SCHEMBL7070910 0.90 MAPT (0.42) PPARGPPARAPPARDALDH1A1KDM4E
SCHEMBL7066084 0.89 NUDT1 (0.41) PPARGPPARAPPARDMAPTABCB1
SCHEMBL7070111 0.85 PPARA (0.58) PPARGPPARAPPARD
SCHEMBL7066803 0.85 MAPT (0.42) PPARGPPARAPPARDALDH1A1KDM4E
SCHEMBL7071834 0.84 PPARA (0.43) PPARGPPARAPPARD
SCHEMBL7067840 0.83 PPARG (0.42) PPARGPPARAPPARDMAPT
SCHEMBL7067676 0.83 MAPT (0.40) PPARGPPARAPPARDALDH1A1KDM4E
SCHEMBL7072687 0.83 PPARA (0.39) PPARGPPARAPPARDMAPT
SCHEMBL7069897 0.83 MAPT (0.40) PPARGPPARAPPARDALDH1A1KDM4E
SCHEMBL7069567 0.83 PPARG (0.42) PPARGPPARAPPARDRXFP1KDM4E

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 PPARG 1/4885PPARA 3/4885PPARD 2/4885

“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.