SCHEMBL5620804

SCHEMBL5620804

CCOC(=O)c1cccc(C2=C(c3cc(F)ccc3OC)CCC2)n1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.51
PTGER1 P34995 2/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2C19 P33261 1/20 0.51
CYP1A2 P05177 1/20 0.45
CCNT1 O60563 3/20 0.42
CDK9 P50750 3/20 0.42
SCN9A Q15858 2/20 0.40
GRM7 Q14831 1/20 0.40
MAPT P10636 1/20 0.39
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
CTSA P10619 1/20 0.38
TSHR P16473 1/20 0.37
LMNA P02545 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
SCHEMBL4159378 0.91 CYP1A2 (0.50) CYP2C9PTGER1CYP3A4CYP2C19CYP1A2
SCHEMBL4155131 0.88 PTGER1 (0.54) CYP2C9PTGER1CYP3A4CYP2C19CYP1A2
SCHEMBL4156061 0.88 CYP1A2 (0.45) CYP2C9PTGER1CYP3A4CYP2C19CYP1A2
SCHEMBL4147273 0.86 PTGER1 (0.63) CYP2C9PTGER1CYP3A4CYP2C19
SCHEMBL4919224 0.86 CYP1A2 (0.45) CYP2C9PTGER1CYP3A4CYP2C19CYP1A2
SCHEMBL4914240 0.86 PTGER1 (0.51) CYP2C9PTGER1CYP3A4CYP2C19CYP1A2
SCHEMBL4168697 0.83 PTGER1 (0.72) CYP2C9PTGER1CYP3A4CYP2C19
SCHEMBL13696705 0.83 CYP1A2 (0.44) CYP2C9PTGER1CYP3A4CYP2C19CYP1A2
SCHEMBL5620890 0.82 PTGER1 (0.53) CYP2C9PTGER1CYP3A4CYP2C19CYP1A2
SCHEMBL5621106 0.82 PTGER1 (0.68) CYP2C9PTGER1CYP3A4CYP2C19SCN9A

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-7232821-B2 (2-((2-alkoxy)-phenyl) -cyclopent-1enyl) aromatic carbo and heterocyclic acid and derivatives GLAXO GROUP LIMITED (GB) 2007-06-19 US disclosed
US-20050239802-A1 (2-((2-alkoxy)-phenyl)-cyclopent-1enyl) aromatic carbo and heterocyclic acid and derivatives GLAXO GROUP LIMITED (GB) 2005-10-27 US disclosed
EP-1492757-A1 (2-((2-ALKOXY)-PHENYL)-CYCLOPENT-1-ENYL) AROMATIC CARBO- AND HETEROCYCLIC CARBOXYLIC ACID AND DERIVATIVES GLAXO GROUP LIMITED (GB) 2005-01-05 EP disclosed
WO-2003084917-A1 (2-((2-ALKOXY) -PHENYL) -CYCLOPENT-1-ENYL) AROMATIC CARBO AND HETEROCYCLIC ACID AND DERIVATIVES GLAXO GROUP LIMITED (GB) 2003-10-16 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-20050239802-A1 (2-((2-alkoxy)-phenyl)-cyclopent-1enyl) aromatic carbo and heterocyclic acid and derivatives CYP2C9, CYP2C19, CNR1 CYP2C9 1/4885PTGER1 323/4885CYP3A4 43/4885

“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.