SCHEMBL7066077

SCHEMBL7066077

CC(=O)C(Cc1ccc(OCc2cnc3ccccc3c2)cc1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.47
PPARG P37231 8/20 0.47
PPARA Q07869 8/20 0.47
PPARD Q03181 4/20 0.47
ACACB O00763 1/20 0.46
TPH1 P17752 1/20 0.46
CYSLTR2 Q9NS75 3/20 0.45
CYSLTR1 Q9Y271 3/20 0.45
FFAR1 O14842 1/20 0.43
AKR1B1 P15121 1/20 0.43
ALOX5 P09917 3/20 0.43
PTGS1 P23219 1/20 0.43
PTGS2 P35354 1/20 0.43
ALOX5AP P20292 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
SCHEMBL7069546 0.95 ACACB (0.47) MAOBPPARGPPARAPPARDACACB
SCHEMBL7065958 0.89 MAOB (0.46) MAOBPPARGPPARAPPARDACACB
SCHEMBL7067684 0.86 MAOB (0.47) MAOBPPARGPPARAPPARDACACB
SCHEMBL7068771 0.85 PPARG (0.55) MAOBPPARGPPARAPPARDCYSLTR2
SCHEMBL7067707 0.85 CYSLTR2 (0.46) MAOBPPARGPPARAPPARDTPH1
SCHEMBL7065976 0.85 MAOB (0.46) MAOBPPARGPPARAPPARDACACB
SCHEMBL7070013 0.84 PPARA (0.67) PPARGPPARAPPARD
SCHEMBL7069269 0.83 PPARG (0.68) PPARGPPARA
SCHEMBL7066080 0.83 SMN1; SMN2 (0.41) ACACBTPH1
SCHEMBL7069252 0.83 MAOB (0.44) MAOBPPARGPPARAPPARDACACB

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 MAOB 2959/4885PPARG 1/4885PPARA 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.