SCHEMBL4090959

SCHEMBL4090959

CNc1cc(C)n(Cc2cc(Cl)ccc2OCc2ccccc2)n1

nearest known ligand 0.76

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 20/20 0.76
CYP2C9 P11712 2/20 0.70
CYP1A2 P05177 1/20 0.70
CYP2C19 P33261 1/20 0.70

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
SCHEMBL4096704 0.89 PTGER1 (0.89) PTGER1CYP2C9CYP1A2CYP2C19
SCHEMBL4085520 0.88 PTGER1 (0.74) PTGER1CYP2C9CYP1A2CYP2C19
SCHEMBL13694752 0.87 PTGER1 (0.60) PTGER1CYP2C9CYP1A2CYP2C19
SCHEMBL4091451 0.87 PTGER1 (1.00) PTGER1CYP2C9CYP1A2CYP2C19
SCHEMBL13693293 0.86 PTGER1 (1.00) PTGER1CYP2C9CYP1A2CYP2C19
SCHEMBL4092108 0.85 PTGER1 (0.70) PTGER1CYP2C9CYP1A2CYP2C19
SCHEMBL13693298 0.85 PTGER1 (1.00) PTGER1CYP2C9CYP1A2CYP2C19
SCHEMBL4092606 0.85 PTGER1 (1.00) PTGER1CYP2C9CYP1A2CYP2C19
SCHEMBL4095687 0.85 PTGER1 (1.00) PTGER1CYP2C9CYP1A2CYP2C19
SCHEMBL4095567 0.85 PTGER1 (1.00) PTGER1CYP2C9CYP1A2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090239845-A1 PYRAZOLE COMPOUNDS AS PROSTAGLANDIN RECEPTORS LIGANDS CONWAY ELIZABETH ANN 2009-09-24 US disclosed
US-20090239845-A1 PYRAZOLE COMPOUNDS AS PROSTAGLANDIN RECEPTORS LIGANDS CONWAY ELIZABETH ANN 2009-09-24 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-20090239845-A1 PYRAZOLE COMPOUNDS AS PROSTAGLANDIN RECEPTORS LIGANDS PTGER1, PTGDR, PTGIR PTGER1 1/4885CYP2C9 189/4885CYP1A2 150/4885

“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.