SCHEMBL4159535

SCHEMBL4159535

CCOC(=O)c1cc(C2=C(c3cc(Cl)ccc3OCc3ccc(F)cc3Cl)CCC2)cnc1CC

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 20/20 0.59
CYP2C9 P11712 7/20 0.59
CYP3A4 P08684 3/20 0.49
CYP2C19 P33261 3/20 0.49
CYP1A2 P05177 2/20 0.41

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
SCHEMBL4149575 0.94 PTGER1 (0.59) PTGER1CYP2C9CYP3A4CYP2C19
SCHEMBL4164300 0.92 PTGER1 (0.67) PTGER1CYP2C9CYP3A4CYP2C19CYP1A2
SCHEMBL4154694 0.91 PTGER1 (0.66) PTGER1CYP2C9CYP3A4CYP2C19CYP1A2
SCHEMBL4154629 0.90 PTGER1 (0.72) PTGER1CYP2C9CYP3A4CYP2C19
SCHEMBL4441645 0.90 PTGER1 (0.55) PTGER1CYP2C9CYP3A4CYP2C19
SCHEMBL4150335 0.89 PTGER1 (0.55) PTGER1CYP2C9CYP3A4CYP2C19
SCHEMBL4161806 0.88 PTGER1 (0.57) PTGER1CYP2C9CYP3A4CYP2C19
SCHEMBL4162136 0.87 PTGER1 (0.64) PTGER1CYP2C9CYP3A4CYP2C19
SCHEMBL4147106 0.86 PTGER1 (0.55) PTGER1CYP2C9CYP3A4CYP2C19
SCHEMBL4162182 0.85 PTGER1 (0.62) PTGER1CYP2C9CYP3A4CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090227591-A1 Cyclopentene compounds GLAXO GROUP LIMITED (GB) 2009-09-10 US disclosed
US-20090227591-A1 Cyclopentene compounds GLAXO GROUP LIMITED (GB) 2009-09-10 US disclosed
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 PTGER1 246/4885CYP2C9 5/4885CYP3A4 271/4885

“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.