SCHEMBL2394657

SCHEMBL2394657

N#Cc1cccc(Oc2cc(C(F)(F)F)ccc2C=O)c1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPAS1 Q99814 6/20 0.46
VEGFA P15692 3/20 0.46
MRGPRX4 Q96LA9 1/20 0.43
PTGDR2 Q9Y5Y4 1/20 0.41
L3MBTL1 Q9Y468 3/20 0.40
POLB P06746 3/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
P2RY1 P47900 1/20 0.37
MAP4K4 O95819 1/20 0.37
AR P10275 1/20 0.37
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL4613870 0.81 LMNA (0.57) L3MBTL1POLBALDH1A1MAPTNPSR1
SCHEMBL891091 0.78 L3MBTL1 (0.65) EPAS1VEGFAMRGPRX4PTGDR2L3MBTL1
SCHEMBL921315 0.78 POLB (0.51) EPAS1VEGFAMRGPRX4L3MBTL1POLB
SCHEMBL2398431 0.78 MRGPRX4 (0.46) EPAS1VEGFAMRGPRX4PTGDR2L3MBTL1
SCHEMBL5037397 0.76 LMNA (0.57) ALDH1A1NPSR1ARLMNAGAA
SCHEMBL22809585 0.75 SCN8A (0.48) EPAS1MRGPRX4PTGDR2L3MBTL1MAPT
SCHEMBL14663781 0.75 EPAS1 (0.49) EPAS1VEGFAMRGPRX4L3MBTL1POLB
SCHEMBL29777469 0.75 MRGPRX4 (0.48) EPAS1VEGFAMRGPRX4PTGDR2L3MBTL1
SCHEMBL2393446 0.75 PPARG (0.47) EPAS1VEGFAMRGPRX4PTGDR2
SCHEMBL4874724 0.75 PTGDR2 (0.48) EPAS1VEGFAMRGPRX4PTGDR2P2RY1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1765768-B1 SUBSTITUTED ACIDS FOR THE TREATMENT OF RESPIRATORY DISEASES ASTRAZENECA AB (SE) 2013-11-06 EP disclosed
US-8022248-B2 3-[2-(3-Cyanophenoxy)-4-(trifluoromethyl)phenyl]propanoic acid;prostaglandin D2 inhibitor, orphan receptor CRTH2 antagonist; antiinflammatory, analgesic, antipyretic; respiratory system disorders: asthma and rhinitis; coupling amino/thio-phenyl derivatives with ester followed by hydrolysis to acid ASTRAZENECA AB (SE) 2011-09-20 US disclosed
US-20080114002-A1 Substituted Acids for the Treatment of Respiratory Diseases ASTRAZENECA AB (SE) 2008-05-15 US disclosed
EP-1765768-A1 SUBSTITUTED ACIDS FOR THE TREATMENT OF RESPIRATORY DISEASES AstraZeneca AB (SE) 2007-03-28 EP disclosed
WO-2006005909-A1 SUBSTITUTED ACIDS FOR THE TREATMENT OF RESPIRATORY DISEASES ASTRAZENECA AB (SE) 2006-01-19 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-20080114002-A1 Substituted Acids for the Treatment of Respiratory Diseases HRH2, HRH1, HRH4 EPAS1 3046/4885VEGFA 2367/4885MRGPRX4 7/4885

“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.