SCHEMBL13697462

SCHEMBL13697462

CCCCOc1ccc(C(F)(F)F)cc1C1=C(c2ccc(Cl)c(C(=O)OCC)n2)CCC1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 3/20 0.45
PTGER1 P34995 3/20 0.42
CYP2C9 P11712 2/20 0.41
MRGPRX4 Q96LA9 2/20 0.40
PPARD Q03181 5/20 0.40
PPARA Q07869 3/20 0.40
MAPT P10636 1/20 0.39
NR1I2 O75469 1/20 0.37
PPARG P37231 2/20 0.37
PDE5A O76074 2/20 0.36
PDE6D O43924 1/20 0.36
PDE6A P16499 1/20 0.36
PDE6G P18545 1/20 0.36
PDE6B P35913 1/20 0.36
PDE6C P51160 1/20 0.36
PDE6H Q13956 1/20 0.36
MAOB P27338 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C19 P33261 1/20 0.36

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
SCHEMBL4155948 0.88 PTGER1 (0.57) PTGER1CYP2C9MRGPRX4MAOBCYP3A4
SCHEMBL4147278 0.87 MAPT (0.39) PTGER1CYP2C9MRGPRX4MAPTPDE5A
SCHEMBL4159453 0.85 PTGER1 (0.48) PTGER1CYP2C9MRGPRX4PPARDPPARA
SCHEMBL4444095 0.84 PTGER1 (0.55) PTGER1CYP2C9MRGPRX4CYP3A4CYP2C19
SCHEMBL4162804 0.81 PTGER1 (0.49) PTGDR2PTGER1CYP2C9MRGPRX4MAOB
SCHEMBL4168478 0.81 PTGER1 (0.48) PTGER1CYP2C9MRGPRX4PPARDPPARA
SCHEMBL4154448 0.80 MRGPRX4 (0.44) PTGER1CYP2C9MRGPRX4PPARDMAPT
SCHEMBL4150131 0.79 PTGER1 (0.59) PTGER1CYP2C9PPARDMAOB
SCHEMBL13697347 0.79 PTGER1 (0.49) PTGER1CYP2C9PPARDPPARAMAOB
SCHEMBL13697453 0.79 PTGER1 (0.57) PTGER1CYP2C9MRGPRX4PPARDPPARA

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-20090227591-A1 Cyclopentene compounds GLAXO GROUP LIMITED (GB) 2009-09-10 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-20090227591-A1 Cyclopentene compounds C1R, CYP1B1, ADORA2B PTGDR2 231/4885PTGER1 246/4885CYP2C9 5/4885

“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.