SCHEMBL534002

SCHEMBL534002

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

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 2/20 0.59
TSHR P16473 1/20 0.40
HTR2A P28223 1/20 0.40
HTR2C P28335 1/20 0.40
HTR2B P41595 1/20 0.40
PPARG P37231 11/20 0.39
P2RX3 P56373 4/20 0.37
PPARA Q07869 5/20 0.36
PPARD Q03181 3/20 0.35
EPHX2 P34913 1/20 0.34

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
SCHEMBL533914 1.00 PTGDR2 (0.59) PTGDR2TSHRHTR2AHTR2CHTR2B
SCHEMBL534119 0.91 PTGDR2 (0.55) PTGDR2P2RX3
SCHEMBL534118 0.91 PTGDR2 (0.55) PTGDR2P2RX3
SCHEMBL3770942 0.88 PTGDR2 (0.74) PTGDR2TSHRPPARGP2RX3PPARA
SCHEMBL3778499 0.88 PTGDR2 (0.48) PTGDR2TSHRHTR2AHTR2CHTR2B
SCHEMBL3778507 0.88 PTGDR2 (0.48) PTGDR2TSHRHTR2AHTR2CHTR2B
SCHEMBL3782624 0.85 PTGDR2 (0.63) PTGDR2TSHRP2RX3
SCHEMBL3776129 0.81 PTGDR2 (0.78) PTGDR2PPARD
SCHEMBL3779879 0.81 PTGDR2 (0.64) PTGDR2TSHRP2RX3PPARD
SCHEMBL534256 0.80 PTGDR2 (0.73) PTGDR2TSHRPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2129661-B1 QUINOLINE DERIVATIVES AS CRTH2 RECEPTOR LIGANDS PULMAGEN THERAPEUTICS ASTHMA LTD (GB) 2012-02-08 EP claimed
US-20100144786-A1 QUINOLINE DERIVATIVES AS CRTH2 RECEPTOR LIGANDS PULMAGEN THERAPEUTICS (ASTHMA) LIMITED (GB) 2010-06-10 US claimed
EP-2129661-B1 QUINOLINE DERIVATIVES AS CRTH2 RECEPTOR LIGANDS PULMAGEN THERAPEUTICS ASTHMA LTD (GB) 2012-02-08 EP disclosed
US-20100144786-A1 QUINOLINE DERIVATIVES AS CRTH2 RECEPTOR LIGANDS PULMAGEN THERAPEUTICS (ASTHMA) LIMITED (GB) 2010-06-10 US disclosed
EP-2129661-A1 QUINOLINE DERIVATIVES AS CRTH2 RECEPTOR LIGANDS Argenta Oral Therapeutics Limited (GB) 2009-12-09 EP disclosed
WO-2008119917-A1 QUINOLINE DERIVATIVES AS CRTH2 RECEPTOR LIGANDS ARGENTA DISCOVERY LIMITED (GB) 2008-10-09 WO 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-20100144786-A1 QUINOLINE DERIVATIVES AS CRTH2 RECEPTOR LIGANDS NR1H2, GPR52, HRH2 PTGDR2 75/4885TSHR 447/4885HTR2A 316/4885

“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.