SCHEMBL3582433

SCHEMBL3582433

COc1ccc(Cl)cc1Cn1nc(NC(=O)c2ccc3c(c2)CCN(C(=O)OC(C)(C)C)C3)cc1C

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 20/20 0.63
CYP2C9 P11712 1/20 0.50

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
SCHEMBL4090882 0.91 PTGER1 (0.77) PTGER1
SCHEMBL3587201 0.90 PTGER1 (0.50) PTGER1CYP2C9
SCHEMBL3176691 0.90 PTGER1 (0.57) PTGER1CYP2C9
SCHEMBL13960302 0.90 PTGER1 (0.62) PTGER1CYP2C9
SCHEMBL3176471 0.89 PTGER1 (0.55) PTGER1CYP2C9
SCHEMBL4085504 0.87 PTGER1 (0.77) PTGER1
SCHEMBL3186031 0.86 PTGER1 (0.52) PTGER1CYP2C9
SCHEMBL3186899 0.85 PTGER1 (0.52) PTGER1CYP2C9
SCHEMBL3180343 0.84 PTGER1 (0.50) PTGER1CYP2C9
SCHEMBL3179360 0.84 PTGER1 (0.49) PTGER1CYP2C9

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-20100048617-A1 COMPOUNDS SMITHKLINE BEECHAM CORP. 2010-02-25 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-20100048617-A1 COMPOUNDS SCD, SCD5, CYP11B2 PTGER1 928/4885CYP2C9 31/4885

“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.