SCHEMBL4403512

SCHEMBL4403512

CCc1nc2c(F)ccc(OCC(=O)O)c2c(OC(F)F)c1Cc1ccc(C(=O)C(F)(F)F)cc1

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.69
TTR P02766 1/20 0.32
PPARD Q03181 14/20 0.32
PPARA Q07869 5/20 0.32
PPARG P37231 3/20 0.32
DHFR P00374 2/20 0.32
FFAR1 O14842 1/20 0.31

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
SCHEMBL534038 0.91 PTGDR2 (0.72) PTGDR2TTRPPARDPPARAPPARG
SCHEMBL13321253 0.90 PTGDR2 (0.71) PTGDR2TTRPPARDDHFRFFAR1
SCHEMBL3776129 0.90 PTGDR2 (0.78) PTGDR2PPARDFFAR1
SCHEMBL3770942 0.89 PTGDR2 (0.74) PTGDR2PPARDPPARAPPARGFFAR1
SCHEMBL2574995 0.88 PTGDR2 (0.69) PTGDR2PPARDPPARAPPARGFFAR1
SCHEMBL534188 0.88 PTGDR2 (0.71) PTGDR2PPARDPPARAPPARGFFAR1
SCHEMBL534256 0.88 PTGDR2 (0.73) PTGDR2PPARDFFAR1
SCHEMBL2574688 0.87 PTGDR2 (0.72) PTGDR2PPARDPPARAPPARGFFAR1
SCHEMBL2570543 0.87 PTGDR2 (0.74) PTGDR2PPARDPPARADHFRFFAR1
SCHEMBL3772926 0.86 PTGDR2 (0.68) PTGDR2PPARDPPARAPPARG

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8173812-B2 Quinolines and their therapeutic use PULMAGEN THERAPEUTICS (ASTHMA) LIMITED (GB) 2012-05-08 US disclosed
US-8173812-B2 Quinolines and their therapeutic use PULMAGEN THERAPEUTICS (ASTHMA) LIMITED (GB) 2012-05-08 US disclosed
US-20100144787-A1 Quinolines and Their Therapeutic Use GB005, INC. 2010-06-10 US disclosed
US-20100144787-A1 Quinolines and Their Therapeutic Use GB005, INC. 2010-06-10 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-20100144787-A1 Quinolines and Their Therapeutic Use CHRM3, CHRM2, HRH1 PTGDR2 301/4885TTR 3897/4885PPARD 1386/4885

“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.